A1IBN
Summary
| Name: | 5-[(~{Z})-(3,5-diethyl-4-methoxy-phenyl)diazenyl]-2-methyl-phenol |
| Formula: | C18 H22 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 298.379 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-[(~{Z})-(3,5-diethyl-4-methoxy-phenyl)diazenyl]-2-methyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H22N2O2/c1-5-13-9-16(10-14(6-2)18(13)22-4)20-19-15-8-7-12(3)17(21)11-15/h7-11,21H,5-6H2,1-4H3/b20-19- |
| InChIKey | InChI | 1.06 | BEBLURJWHJAXSU-VXPUYCOJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1cc(cc(CC)c1OC)N=Nc2ccc(C)c(O)c2 |
| SMILES | CACTVS | 3.385 | CCc1cc(cc(CC)c1OC)N=Nc2ccc(C)c(O)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1cc(cc(c1OC)CC)/N=N\c2ccc(c(c2)O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCc1cc(cc(c1OC)CC)N=Nc2ccc(c(c2)O)C |
