[2-[(E)-3-(2,5-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-[(E)-3-(2,5-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-methylbenzoate Openeye Name: [2-[(E)-3-(2,5-dimethoxyphenyl)-3-oxo-prop-1-enyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[(E)-3-(2,5-dimethoxyphenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(2,5-dimethoxyphenyl)-3-oxoprop-1-enyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[(E)-3-(2,5-dimethoxyphenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C25H22O5 MolecularWeight: 402.43918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=CC(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2/C=C/C(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C25H22O5/c1-17-8-10-19(11-9-17)25(27)30-23-7-5-4-6-18(23)12-14-22(26)21-16-20(28-2)13-15-24(21)29-3/h4-16H,1-3H3/b14-12+