[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C21H21BrO7 MolecularWeight: 465.29124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C=CC2=CC(=C(C=C2OC)OC)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)/C=C/C2=CC(=C(C=C2OC)OC)OC)Br

InChI

InChI=1S/C21H21BrO7/c1-25-17-7-5-13(9-15(17)22)16(23)12-29-21(24)8-6-14-10-19(27-3)20(28-4)11-18(14)26-2/h5-11H,12H2,1-4H3/b8-6+