A07
Summary
| Name: | N-(6-chloro-5-phenyl-1H-indazol-3-yl)butanamide |
| Formula: | C17 H16 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 313.781 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | N-(6-chloro-5-phenyl-1H-indazol-3-yl)butanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | CCCC(=O)Nc1n[nH]c2cc(Cl)c(cc12)c3ccccc3 |
| SMILES | CACTVS | 3.352 | CCCC(=O)Nc1n[nH]c2cc(Cl)c(cc12)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CCCC(=O)Nc1c2cc(c(cc2[nH]n1)Cl)c3ccccc3 |
| SMILES | OpenEye OEToolkits | 1.7.0 | CCCC(=O)Nc1c2cc(c(cc2[nH]n1)Cl)c3ccccc3 |
| InChI | InChI | 1.03 | InChI=1S/C17H16ClN3O/c1-2-6-16(22)19-17-13-9-12(11-7-4-3-5-8-11)14(18)10-15(13)20-21-17/h3-5,7-10H,2,6H2,1H3,(H2,19,20,21,22) |
| InChIKey | InChI | 1.03 | WGVVIVGNBSSANI-UHFFFAOYSA-N |
