[2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]phenyl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]phenyl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]phenyl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [2-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]phenyl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]phenyl] ester Formula: C27H20O7 MolecularWeight: 456.4435

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=CC=C2OC(=O)C3=CC4=CC=CC=C4OC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=CC=C2OC(=O)C3=CC4=CC=CC=C4OC3=O)OC

InChI

InChI=1S/C27H20O7/c1-31-24-14-12-17(15-25(24)32-2)11-13-21(28)19-8-4-6-10-23(19)34-27(30)20-16-18-7-3-5-9-22(18)33-26(20)29/h3-16H,1-2H3/b13-11+