EHO
Summary
Name: | 2-phenylazanylbenzoic acid |
Formula: | C13 H11 N O2 |
Formal charge: | 0 |
Formula weight: | 213.232 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-phenylazanylbenzoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16) |
InChIKey | InChI | 1.03 | ZWJINEZUASEZBH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccccc1Nc2ccccc2 |
SMILES | CACTVS | 3.385 | OC(=O)c1ccccc1Nc2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Nc2ccccc2C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Nc2ccccc2C(=O)O |