
 5-(4-bromophenyl)-N-phenyl-2-furamide

 33 35  0  0  0  0  0  0  0  0999 V2000
   -0.1168   -4.0359   -1.9350 C   0  0  0  0  0
    1.0940   -4.6320   -2.2752 C   0  0  0  0  0
    2.2888   -3.9248   -2.1172 C   0  0  0  0  0
    2.2854   -2.6158   -1.6170 C   0  0  0  0  0
    1.0655   -2.0258   -1.2826 C   0  0  0  0  0
   -0.1306   -2.7340   -1.4405 C   0  0  0  0  0
    3.5326   -1.9818   -1.4754 N   0  0  0  0  0
    3.8050   -0.7105   -1.0017 C   0  0  0  0  0
    2.9706    0.1131   -0.6429 O   0  0  0  0  0
    5.2296   -0.4280   -0.9612 C   0  0  0  0  0
    5.9223    0.6951   -0.5568 C   0  0  0  0  0
    7.2983    0.4056   -0.7218 C   0  0  0  0  0
    7.3810   -0.8803   -1.2208 C   0  0  0  0  0
    6.1192   -1.3885   -1.3691 O   0  0  0  0  0
    8.4846   -1.7621   -1.5989 C   0  0  0  0  0
    8.2491   -3.0563   -2.0909 C   0  0  0  0  0
    9.3088   -3.8962   -2.4497 C   0  0  0  0  0
   10.6192   -3.4474   -2.3190 C   0  0  0  0  0
   10.8787   -2.1691   -1.8340 C   0  0  0  0  0
    9.8155   -1.3323   -1.4763 C   0  0  0  0  0
   12.0535   -4.5791   -2.8025 Br  0  0  0  0  0
   -1.0482   -4.5831   -2.0537 H   0  0  0  0  0
    1.1100   -5.6477   -2.6619 H   0  0  0  0  0
    3.2205   -4.4141   -2.3887 H   0  0  0  0  0
    1.0064   -1.0150   -0.8920 H   0  0  0  0  0
   -1.0734   -2.2632   -1.1729 H   0  0  0  0  0
    4.3533   -2.5170   -1.7365 H   0  0  0  0  0
    5.4751    1.6071   -0.1842 H   0  0  0  0  0
    8.1277    1.0616   -0.4985 H   0  0  0  0  0
    7.2332   -3.4286   -2.2010 H   0  0  0  0  0
    9.0981   -4.8932   -2.8275 H   0  0  0  0  0
   11.9000   -1.8122   -1.7291 H   0  0  0  0  0
   10.0462   -0.3387   -1.0995 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 22  1  0  0  0
  2  3  1  0  0  0
  2 23  1  0  0  0
  3  4  2  0  0  0
  3 24  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
  5  6  2  0  0  0
  5 25  1  0  0  0
  6 26  1  0  0  0
  7  8  1  0  0  0
  7 27  1  0  0  0
  8 10  1  0  0  0
  8  9  2  0  0  0
 10 11  2  0  0  0
 10 14  1  0  0  0
 11 12  1  0  0  0
 11 28  1  0  0  0
 12 13  2  0  0  0
 12 29  1  0  0  0
 13 14  1  0  0  0
 13 15  1  0  0  0
 15 16  2  0  0  0
 15 20  1  0  0  0
 16 17  1  0  0  0
 16 30  1  0  0  0
 17 18  2  0  0  0
 17 31  1  0  0  0
 18 19  1  0  0  0
 18 21  1  0  0  0
 19 20  2  0  0  0
 19 32  1  0  0  0
 20 33  1  0  0  0
M  END

>  <Chemical Name>
5-(4-bromophenyl)-N-phenyl-2-furamide

>  <PubChem CID>
2904011

>  <Formula>
C17H12BrNO2

>  <Molecular Weight>
342.192000

>  <IUPAC Name>
5-(4-bromophenyl)-N-phenylfuran-2-carboxamide

>  <XlogP>
4.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br

>  <Isomeric SMILES>
C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br

>  <InChI Std. ID>
InChI=1S/C17H12BrNO2/c18-13-8-6-12(7-9-13)15-10-11-16(21-15)17(20)19-14-4-2-1-3-5-14/h1-11H,(H,19,20)

>  <InChI Key>
ACFDHRGCMPAHBH-UHFFFAOYSA-N

