4-[[2-methoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-methoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C18H16O6 MolecularWeight: 328.31604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)O)OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)O)OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H16O6/c1-23-16-10-12(5-9-17(19)20)4-8-15(16)24-11-13-2-6-14(7-3-13)18(21)22/h2-10H,11H2,1H3,(H,19,20)(H,21,22)/b9-5+