dimethyl 5-[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-yl]sulfonylbenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-yl]sulfonylbenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-yl]sulfonylbenzene-1,3-dicarboxylate CAS Name: 5-[[(2R)-2-[dimethylamino(oxo)methyl]-1-pyrrolidinyl]sulfonyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2R)-2-(dimethylcarbamoyl)pyrrolidin-1-yl]sulfonylbenzene-1,3-dicarboxylate Traditional Name: 5-[(2R)-2-(dimethylcarbamoyl)pyrrolidino]sulfonylbenzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H22N2O7S MolecularWeight: 398.43078

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCCN1S(=O)(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CN(C)C(=O)[C@H]1CCCN1S(=O)(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H22N2O7S/c1-18(2)15(20)14-6-5-7-19(14)27(23,24)13-9-11(16(21)25-3)8-12(10-13)17(22)26-4/h8-10,14H,5-7H2,1-4H3/t14-/m1/s1