
 2-(4-chlorophenyl)-N'-(3-pyridinylmethylene)-4-quinolinecarbohydrazide

 43 46  0  0  0  0  0  0  0  0999 V2000
   -2.6003   -0.1246    0.7832 C   0  0  0  0  0
   -2.3993    1.2272    0.5558 C   0  0  0  0  0
   -1.1159    1.6920    0.2640 C   0  0  0  0  0
   -0.0234    0.8389    0.1767 C   0  0  0  0  0
   -0.2176   -0.5419    0.3623 C   0  0  0  0  0
   -1.5192   -1.0001    0.6984 C   0  0  0  0  0
    0.9350   -1.3503    0.2262 C   0  0  0  0  0
    2.1911   -0.7716    0.0137 C   0  0  0  0  0
    2.2835    0.6035   -0.1135 C   0  0  0  0  0
    1.1799    1.3875   -0.0575 N   0  0  0  0  0
    3.5685    1.3226   -0.2632 C   0  0  0  0  0
    3.7166    2.6304    0.2434 C   0  0  0  0  0
    4.9267    3.3257    0.1443 C   0  0  0  0  0
    6.0169    2.7236   -0.4722 C   0  0  0  0  0
    5.9032    1.4384   -0.9932 C   0  0  0  0  0
    4.6891    0.7465   -0.8907 C   0  0  0  0  0
    7.5096    3.5694   -0.5928 Cl  0  0  0  0  0
    0.9396   -2.8234    0.4007 C   0  0  0  0  0
    1.7331   -3.3307    1.1906 O   0  0  0  0  0
    0.0865   -3.6168   -0.3385 N   0  0  0  0  0
   -0.7192   -3.1452   -1.3266 N   0  0  0  0  0
   -1.6200   -3.9825   -1.7339 C   0  0  0  0  0
   -2.6108   -3.6143   -2.7543 C   0  0  0  0  0
   -3.7402   -4.4037   -2.9182 C   0  0  0  0  0
   -4.7241   -4.1290   -3.8065 N   0  0  0  0  0
   -4.5654   -3.0186   -4.5621 C   0  0  0  0  0
   -3.4687   -2.1736   -4.4715 C   0  0  0  0  0
   -2.4735   -2.4757   -3.5448 C   0  0  0  0  0
   -3.5906   -0.5001    1.0267 H   0  0  0  0  0
   -3.2296    1.9254    0.6176 H   0  0  0  0  0
   -0.9604    2.7577    0.1097 H   0  0  0  0  0
   -1.7003   -2.0535    0.8954 H   0  0  0  0  0
    3.0754   -1.4000   -0.0085 H   0  0  0  0  0
    2.8749    3.1175    0.7356 H   0  0  0  0  0
    5.0049    4.3295    0.5527 H   0  0  0  0  0
    6.7519    0.9666   -1.4811 H   0  0  0  0  0
    4.6325   -0.2506   -1.3218 H   0  0  0  0  0
    0.1364   -4.6130   -0.1493 H   0  0  0  0  0
   -1.7094   -4.9951   -1.2990 H   0  0  0  0  0
   -3.9105   -5.2934   -2.3188 H   0  0  0  0  0
   -5.3705   -2.8175   -5.2639 H   0  0  0  0  0
   -3.3930   -1.2966   -5.1053 H   0  0  0  0  0
   -1.6056   -1.8289   -3.4448 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 29  1  0  0  0
  2  3  1  0  0  0
  2 30  1  0  0  0
  3  4  2  0  0  0
  3 31  1  0  0  0
  4 10  1  0  0  0
  4  5  1  0  0  0
  5  6  2  0  0  0
  5  7  1  0  0  0
  6 32  1  0  0  0
  7  8  2  0  0  0
  7 18  1  0  0  0
  8  9  1  0  0  0
  8 33  1  0  0  0
  9 10  2  0  0  0
  9 11  1  0  0  0
 11 12  2  0  0  0
 11 16  1  0  0  0
 12 13  1  0  0  0
 12 34  1  0  0  0
 13 14  2  0  0  0
 13 35  1  0  0  0
 14 15  1  0  0  0
 14 17  1  0  0  0
 15 16  2  0  0  0
 15 36  1  0  0  0
 16 37  1  0  0  0
 18 20  1  0  0  0
 18 19  2  0  0  0
 20 21  1  0  0  0
 20 38  1  0  0  0
 21 22  2  0  0  0
 22 23  1  0  0  0
 22 39  1  0  0  0
 23 24  2  0  0  0
 23 28  1  0  0  0
 24 25  1  0  0  0
 24 40  1  0  0  0
 25 26  2  0  0  0
 26 27  1  0  0  0
 26 41  1  0  0  0
 27 28  2  0  0  0
 27 42  1  0  0  0
 28 43  1  0  0  0
M  END

>  <Chemical Name>
2-(4-chlorophenyl)-N'-(3-pyridinylmethylene)-4-quinolinecarbohydrazide

>  <PubChem CID>
6874043

>  <Formula>
C22H15ClN4O

>  <Molecular Weight>
386.839000

>  <IUPAC Name>
2-(4-chlorophenyl)-N-[(E)-pyridin-3-ylmethylideneamino]quinoline-4-carboxamide

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)NN=CC4=CN=CC=C4

>  <Isomeric SMILES>
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)N/N=C/C4=CN=CC=C4

>  <InChI Std. ID>
InChI=1S/C22H15ClN4O/c23-17-9-7-16(8-10-17)21-12-19(18-5-1-2-6-20(18)26-21)22(28)27-25-14-15-4-3-11-24-13-15/h1-14H,(H,27,28)/b25-14+

>  <InChI Key>
AADCXZXYAUHWRX-AFUMVMLFSA-N

