[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(4-chloranylphenoxy)butanoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(4-chloranylphenoxy)butanoate Openeye Name: [2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] 4-(4-chlorophenoxy)butanoate CAS Name: 4-(4-chlorophenoxy)butanoic acid [2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxochromen-3-yl] 4-(4-chlorophenoxy)butanoate Traditional Name: 4-(4-chlorophenoxy)butyric acid [2-(3,4-dimethoxyphenyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C29H27ClO7 MolecularWeight: 522.97348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OC(=O)CCCOC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OC(=O)CCCOC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C29H27ClO7/c1-17-14-22-24(15-18(17)2)36-28(19-7-12-23(33-3)25(16-19)34-4)29(27(22)32)37-26(31)6-5-13-35-21-10-8-20(30)9-11-21/h7-12,14-16H,5-6,13H2,1-4H3