18A
Summary
| Name: | N-{4-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]phenyl}propanamide |
| Synonyms: | (E)-N-(4-(4-hydroxy-3,5-dimethylstyryl)phenyl)propionamide, bound form |
| Formula: | C19 H21 N O2 |
| Formal charge: | 0 |
| Formula weight: | 295.376 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-{4-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]phenyl}propanamide |
| OpenEye OEToolkits | 1.7.6 | N-[4-[(E)-2-(3,5-dimethyl-4-oxidanyl-phenyl)ethenyl]phenyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1ccc(cc1)\C=C\c2cc(c(O)c(c2)C)C)CC |
| InChI | InChI | 1.03 | InChI=1S/C19H21NO2/c1-4-18(21)20-17-9-7-15(8-10-17)5-6-16-11-13(2)19(22)14(3)12-16/h5-12,22H,4H2,1-3H3,(H,20,21)/b6-5+ |
| InChIKey | InChI | 1.03 | XOQSZRKSZAGMSA-AATRIKPKSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCC(=O)Nc1ccc(cc1)/C=C/c2cc(C)c(O)c(C)c2 |
| SMILES | CACTVS | 3.370 | CCC(=O)Nc1ccc(cc1)C=Cc2cc(C)c(O)c(C)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCC(=O)Nc1ccc(cc1)/C=C/c2cc(c(c(c2)C)O)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCC(=O)Nc1ccc(cc1)C=Cc2cc(c(c(c2)C)O)C |
