6-[(E)-3-(2-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[(E)-3-(2-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[(E)-3-(2-carboxyphenyl)-3-oxo-prop-1-enyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[(E)-3-(2-carboxyphenyl)-3-oxoprop-1-enyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[(E)-3-(2-carboxyphenyl)-3-oxoprop-1-enyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[(E)-3-(2-carboxyphenyl)-3-keto-prop-1-enyl]-2,3-dimethoxy-benzoic acid Formula: C19H16O7 MolecularWeight: 356.32614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=CC(=O)C2=CC=CC=C2C(=O)O)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=C/C(=O)C2=CC=CC=C2C(=O)O)C(=O)O)OC

InChI

InChI=1S/C19H16O7/c1-25-15-10-8-11(16(19(23)24)17(15)26-2)7-9-14(20)12-5-3-4-6-13(12)18(21)22/h3-10H,1-2H3,(H,21,22)(H,23,24)/b9-7+