[3-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [3-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 3,4-dimethoxybenzoate Openeye Name: [3-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [3-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C24H19BrO5 MolecularWeight: 467.30866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C=CC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)/C=C/C(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C24H19BrO5/c1-28-22-13-9-18(15-23(22)29-2)24(27)30-20-5-3-4-16(14-20)6-12-21(26)17-7-10-19(25)11-8-17/h3-15H,1-2H3/b12-6+