QPB
Summary
| Name: | methyl (~{Z})-3-(4-hydroxyphenyl)-2-methyl-prop-2-enoate |
| Formula: | C11 H12 O3 |
| Formal charge: | 0 |
| Formula weight: | 192.211 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl (~{Z})-3-(4-hydroxyphenyl)-2-methyl-prop-2-enoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H12O3/c1-8(11(13)14-2)7-9-3-5-10(12)6-4-9/h3-7,12H,1-2H3/b8-7- |
| InChIKey | InChI | 1.03 | CPKCCIUDOPJZSI-FPLPWBNLSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)\C(C)=C/c1ccc(O)cc1 |
| SMILES | CACTVS | 3.385 | COC(=O)C(C)=Cc1ccc(O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C/C(=C/c1ccc(cc1)O)/C(=O)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=Cc1ccc(cc1)O)C(=O)OC |
