[2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3,4-dimethoxybenzoate Openeye Name: [2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]-5-methoxyphenyl] ester IUPAC Name: [2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-[(E)-3-(4-fluorophenyl)acryloyl]-5-methoxy-phenyl] ester Formula: C25H21FO6 MolecularWeight: 436.429043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)F)OC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H21FO6/c1-29-19-10-11-20(21(27)12-6-16-4-8-18(26)9-5-16)23(15-19)32-25(28)17-7-13-22(30-2)24(14-17)31-3/h4-15H,1-3H3/b12-6+