NC0
Summary
| Name: | 2-[(2,3-dihydro-1H-indole-1-carbonyl)amino]benzoic acid |
| Formula: | C16 H14 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 282.294 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[(2,3-dihydro-1H-indole-1-carbonyl)amino]benzoic acid |
| OpenEye OEToolkits | 2.0.7 | 2-(2,3-dihydroindol-1-ylcarbonylamino)benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1ccccc1NC(=O)N1CCc2ccccc21 |
| InChI | InChI | 1.06 | InChI=1S/C16H14N2O3/c19-15(20)12-6-2-3-7-13(12)17-16(21)18-10-9-11-5-1-4-8-14(11)18/h1-8H,9-10H2,(H,17,21)(H,19,20) |
| InChIKey | InChI | 1.06 | SEVISWFLUIXPLQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccccc1NC(=O)N2CCc3ccccc23 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccccc1NC(=O)N2CCc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CCN2C(=O)Nc3ccccc3C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CCN2C(=O)Nc3ccccc3C(=O)O |
