methyl 2-(3,4-dimethoxyphenyl)sulfonyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(3,4-dimethoxyphenyl)sulfonyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: methyl 2-(3,4-dimethoxyphenyl)sulfonyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)sulfonyl-1-oxo-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(3,4-dimethoxyphenyl)sulfonyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)sulfonyl-1-keto-isoquinoline-3-carboxylic acid methyl ester Formula: C19H17NO7S MolecularWeight: 403.40578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2C(=CC3=CC=CC=C3C2=O)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2C(=CC3=CC=CC=C3C2=O)C(=O)OC)OC

InChI

InChI=1S/C19H17NO7S/c1-25-16-9-8-13(11-17(16)26-2)28(23,24)20-15(19(22)27-3)10-12-6-4-5-7-14(12)18(20)21/h4-11H,1-3H3