A1H9M
Summary
| Name: | N-[4-(1H-indazol-5-yl)phenyl]propanamide |
| Synonyms: | N-[4-(1H-indazol-5-yl)phenyl]prop-2-enamide (covalently bound) |
| Formula: | C16 H15 N3 O |
| Formal charge: | 0 |
| Formula weight: | 265.31 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[4-(1~{H}-indazol-5-yl)phenyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H15N3O/c1-2-16(20)18-14-6-3-11(4-7-14)12-5-8-15-13(9-12)10-17-19-15/h3-10H,2H2,1H3,(H,17,19)(H,18,20) |
| InChIKey | InChI | 1.06 | RLWMPXUGNDBLGJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)Nc1ccc(cc1)c2ccc3[nH]ncc3c2 |
| SMILES | CACTVS | 3.385 | CCC(=O)Nc1ccc(cc1)c2ccc3[nH]ncc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1ccc(cc1)c2ccc3c(c2)cn[nH]3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1ccc(cc1)c2ccc3c(c2)cn[nH]3 |
