2-(4-ethoxycarbonyl-3-oxidanylidene-5-phenyl-cyclohexen-1-yl)benzoic acid

Systemtic Name: 2-(4-ethoxycarbonyl-3-oxidanylidene-5-phenyl-cyclohexen-1-yl)benzoic acid Openeye Name: 2-(4-ethoxycarbonyl-3-oxo-5-phenyl-cyclohexen-1-yl)benzoic acid CAS Name: 2-(4-ethoxycarbonyl-3-oxo-5-phenyl-1-cyclohexenyl)benzoic acid IUPAC Name: 2-(4-ethoxycarbonyl-3-oxo-5-phenylcyclohexen-1-yl)benzoic acid Traditional Name: 2-(4-carbethoxy-3-keto-5-phenyl-cyclohexen-1-yl)benzoic acid Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC=CC=C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)C2=CC=CC=C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H20O5/c1-2-27-22(26)20-18(14-8-4-3-5-9-14)12-15(13-19(20)23)16-10-6-7-11-17(16)21(24)25/h3-11,13,18,20H,2,12H2,1H3,(H,24,25)