dipropan-2-yl 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylate

Systemtic Name: dipropan-2-yl 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylate Openeye Name: diisopropyl 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylate CAS Name: 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylate Traditional Name: 5-(3,4-dimethoxyphenyl)benzo[f][1,3]benzodioxole-6,7-dicarboxylic acid diisopropyl ester Formula: C27H28O8 MolecularWeight: 480.50642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C(=C2C=C3C(=CC2=C1)OCO3)C4=CC(=C(C=C4)OC)OC)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C1=C(C(=C2C=C3C(=CC2=C1)OCO3)C4=CC(=C(C=C4)OC)OC)C(=O)OC(C)C

InChI

InChI=1S/C27H28O8/c1-14(2)34-26(28)19-9-17-11-22-23(33-13-32-22)12-18(17)24(25(19)27(29)35-15(3)4)16-7-8-20(30-5)21(10-16)31-6/h7-12,14-15H,13H2,1-6H3