(4-oxidanylidene-4-phenyl-butyl) (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: (4-oxo-4-phenyl-butyl) (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid (4-keto-4-phenyl-butyl) ester Formula: C22H24O6 MolecularWeight: 384.42236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)OCCCC(=O)C2=CC=CC=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)OCCCC(=O)C2=CC=CC=C2)OC)OC

InChI

InChI=1S/C22H24O6/c1-25-19-15-21(27-3)20(26-2)14-17(19)11-12-22(24)28-13-7-10-18(23)16-8-5-4-6-9-16/h4-6,8-9,11-12,14-15H,7,10,13H2,1-3H3/b12-11+