dimethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[2-(p-tolyl)pyrrolidin-1-yl]sulfonyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(4-methylphenyl)-1-pyrrolidinyl]sulfonyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[2-(p-tolyl)pyrrolidino]sulfonyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H23NO6S2 MolecularWeight: 437.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C20H23NO6S2/c1-12-7-9-14(10-8-12)15-6-5-11-21(15)29(24,25)20-16(18(22)26-3)13(2)17(28-20)19(23)27-4/h7-10,15H,5-6,11H2,1-4H3