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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C=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/c1-17-7-10-19(11-8-17)25(27)30-21-6-4-5-18(15-21)9-13-23(26)22-16-20(28-2)12-14-24(22)29-3/h4-16H,1-3H3/b13-9+