ZEI
Summary
| Name: | (2E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide |
| Synonyms: | SB-366791 |
| Formula: | C16 H14 Cl N O2 |
| Formal charge: | 0 |
| Formula weight: | 287.741 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide |
| OpenEye OEToolkits | 2.0.7 | (~{E})-3-(4-chlorophenyl)-~{N}-(3-methoxyphenyl)prop-2-enamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(/C=C/C(=O)Nc2cccc(OC)c2)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C16H14ClNO2/c1-20-15-4-2-3-14(11-15)18-16(19)10-7-12-5-8-13(17)9-6-12/h2-11H,1H3,(H,18,19)/b10-7+ |
| InChIKey | InChI | 1.06 | RYAMDQKWNKKFHD-JXMROGBWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(NC(=O)/C=C/c2ccc(Cl)cc2)c1 |
| SMILES | CACTVS | 3.385 | COc1cccc(NC(=O)C=Cc2ccc(Cl)cc2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)NC(=O)/C=C/c2ccc(cc2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)NC(=O)C=Cc2ccc(cc2)Cl |
