Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1C=C(O)CC(/C=C2\c3ccccc3c3ccccc23)O1 |
InChI | InChI | 1.06 | InChI=1S/C19H14O3/c20-12-9-13(22-19(21)10-12)11-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,10-11,13,20H,9H2/t13-/m0/s1 |
InChIKey | InChI | 1.06 | ZCHUYZRQWDZXJO-ZDUSSCGKSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC1=CC(=O)O[C@@H](C1)C=C2c3ccccc3c4ccccc24 |
SMILES | CACTVS | 3.385 | OC1=CC(=O)O[CH](C1)C=C2c3ccccc3c4ccccc24 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3ccccc3C2=C[C@@H]4CC(=CC(=O)O4)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3ccccc3C2=CC4CC(=CC(=O)O4)O |