[2-[(E)-3-(2-acetyloxyphenyl)-3-oxidanylidene-prop-1-enyl]-6-methoxy-phenyl] benzoate

Systemtic Name: [2-[(E)-3-(2-acetyloxyphenyl)-3-oxidanylidene-prop-1-enyl]-6-methoxy-phenyl] benzoate Openeye Name: [2-[(E)-3-(2-acetoxyphenyl)-3-oxo-prop-1-enyl]-6-methoxy-phenyl] benzoate CAS Name: benzoic acid [2-[(E)-3-(2-acetyloxyphenyl)-3-oxoprop-1-enyl]-6-methoxyphenyl] ester IUPAC Name: [2-[(E)-3-(2-acetyloxyphenyl)-3-oxoprop-1-enyl]-6-methoxyphenyl] benzoate Traditional Name: benzoic acid [2-[(E)-3-(2-acetoxyphenyl)-3-keto-prop-1-enyl]-6-methoxy-phenyl] ester Formula: C25H20O6 MolecularWeight: 416.4227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)C=CC2=C(C(=CC=C2)OC)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)/C=C/C2=C(C(=CC=C2)OC)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H20O6/c1-17(26)30-22-13-7-6-12-20(22)21(27)16-15-18-11-8-14-23(29-2)24(18)31-25(28)19-9-4-3-5-10-19/h3-16H,1-2H3/b16-15+