[2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-fluoranyl-phenyl] 2-methoxybenzoate

Systemtic Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-fluoranyl-phenyl] 2-methoxybenzoate Openeye Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-fluoro-phenyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [2-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-4-fluorophenyl] ester IUPAC Name: [2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-fluorophenyl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [2-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]-4-fluoro-phenyl] ester Formula: C25H21FO6 MolecularWeight: 436.429043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)F)OC(=O)C3=CC=CC=C3OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=C(C=CC(=C2)F)OC(=O)C3=CC=CC=C3OC)OC

InChI

InChI=1S/C25H21FO6/c1-29-21-7-5-4-6-18(21)25(28)32-22-13-10-17(26)15-19(22)20(27)11-8-16-9-12-23(30-2)24(14-16)31-3/h4-15H,1-3H3/b11-8+