2-[(Z)-1-oxidanyl-1-oxidanylidene-2-phenyl-hept-2-en-3-yl]benzoic acid

Systemtic Name: 2-[(Z)-1-oxidanyl-1-oxidanylidene-2-phenyl-hept-2-en-3-yl]benzoic acid Openeye Name: 2-[(1Z)-1-(2-hydroxy-2-oxo-1-phenyl-ethylidene)pentyl]benzoic acid CAS Name: 2-[(Z)-1-hydroxy-1-oxo-2-phenylhept-2-en-3-yl]benzoic acid IUPAC Name: 2-[(Z)-1-hydroxy-1-oxo-2-phenylhept-2-en-3-yl]benzoic acid Traditional Name: 2-[(Z)-1-butyl-3-hydroxy-3-keto-2-phenyl-prop-1-enyl]benzoic acid Formula: C20H20O4 MolecularWeight: 324.3704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C1=CC=CC=C1)C(=O)O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCC/C(=C(\C1=CC=CC=C1)/C(=O)O)/C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C20H20O4/c1-2-3-11-16(15-12-7-8-13-17(15)19(21)22)18(20(23)24)14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3,(H,21,22)(H,23,24)/b18-16-