[4-[(E)-3-(2,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-tert-butylbenzoate

Systemtic Name: [4-[(E)-3-(2,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-tert-butylbenzoate Openeye Name: [4-[(E)-3-(2,4-dimethoxyphenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [4-[(E)-3-(2,4-dimethoxyphenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-3-(2,4-dimethoxyphenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [4-[(E)-3-(2,4-dimethoxyphenyl)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C29H30O6 MolecularWeight: 474.5449

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30O6/c1-29(2,3)21-11-9-20(10-12-21)28(31)35-25-16-8-19(17-27(25)34-6)7-15-24(30)23-14-13-22(32-4)18-26(23)33-5/h7-18H,1-6H3/b15-7+