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

Systemtic Name: [3-[(E)-3-(2,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 2-methylbenzoate Openeye Name: [3-[(E)-3-(2,4-dimethoxyphenyl)-3-oxo-prop-1-enyl]phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-[(E)-3-(2,4-dimethoxyphenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-3-(2,4-dimethoxyphenyl)-3-oxoprop-1-enyl]phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [3-[(E)-3-(2,4-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=CC=C1C(=O)OC2=CC=CC(=C2)C=CC(=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC=CC(=C2)/C=C/C(=O)C3=C(C=C(C=C3)OC)OC

InChI

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