PDB CCD ID: | 49R |
Number of entries in BioLiP: | 1 |
Chemical formula: | C14 H20 N2 O2 |
InChI: | InChI=1S/C14H20N2O2/c1-14(2,3)18-13(17)16-11-8-10-6-4-5-7-12(10)15-9-11/h4-7,11,15H,8-9H2,1-3H3,(H,16,17)/t11-/m1/s1 |
InChIKey: | GAURNOYXRZQBNV-LLVKDONJSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.9.2 | CC(C)(C)OC(=O)NC1Cc2ccccc2NC1 | OpenEye OEToolkits 1.9.2 | CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2NC1 | CACTVS 3.385 | CC(C)(C)OC(=O)N[CH]1CNc2ccccc2C1 | CACTVS 3.385 | CC(C)(C)OC(=O)N[C@H]1CNc2ccccc2C1 | ACDLabs 12.01 | O=C(OC(C)(C)C)NC2Cc1c(cccc1)NC2 |
|
Name: | tert-butyl (3R)-1,2,3,4-tetrahydroquinolin-3-ylcarbamate |
ZINC: | ZINC000004202329 |