C65
Summary
| Name: | (2E)-N-hydroxy-3-{4-[(E)-phenyldiazenyl]phenyl}prop-2-enamide |
| Formula: | C15 H13 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 267.283 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2E)-N-hydroxy-3-{4-[(E)-phenyldiazenyl]phenyl}prop-2-enamide |
| OpenEye OEToolkits | 1.7.6 | (E)-N-oxidanyl-3-[4-[(E)-phenyldiazenyl]phenyl]prop-2-enamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cccc(c1)\N=N\c2ccc(cc2)\C=C\C(NO)=O |
| InChI | InChI | 1.03 | InChI=1S/C15H13N3O2/c19-15(18-20)11-8-12-6-9-14(10-7-12)17-16-13-4-2-1-3-5-13/h1-11,20H,(H,18,19)/b11-8+,17-16+ |
| InChIKey | InChI | 1.03 | FBLBOLZQIKQUIK-USZUYCLASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)/C=C/c1ccc(cc1)N=Nc2ccccc2 |
| SMILES | CACTVS | 3.385 | ONC(=O)C=Cc1ccc(cc1)N=Nc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)/N=N/c2ccc(cc2)/C=C/C(=O)NO |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)N=Nc2ccc(cc2)C=CC(=O)NO |
