dimethyl 7-(3,4-diethoxyphenyl)-4-oxidanyl-1-benzothiophene-5,6-dicarboxylate

Systemtic Name: dimethyl 7-(3,4-diethoxyphenyl)-4-oxidanyl-1-benzothiophene-5,6-dicarboxylate Openeye Name: dimethyl 7-(3,4-diethoxyphenyl)-4-hydroxy-benzothiophene-5,6-dicarboxylate CAS Name: 7-(3,4-diethoxyphenyl)-4-hydroxy-1-benzothiophene-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-(3,4-diethoxyphenyl)-4-hydroxy-1-benzothiophene-5,6-dicarboxylate Traditional Name: 7-(3,4-diethoxyphenyl)-4-hydroxy-benzothiophene-5,6-dicarboxylic acid dimethyl ester Formula: C22H22O7S MolecularWeight: 430.47088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C3C(=C(C(=C2C(=O)OC)C(=O)OC)O)C=CS3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C3C(=C(C(=C2C(=O)OC)C(=O)OC)O)C=CS3)OCC

InChI

InChI=1S/C22H22O7S/c1-5-28-14-8-7-12(11-15(14)29-6-2)16-17(21(24)26-3)18(22(25)27-4)19(23)13-9-10-30-20(13)16/h7-11,23H,5-6H2,1-4H3