methyl 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-1H-pyrrole-2-carboxylate CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(3,5-dimethylpiperidino)sulfonyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OC)C

InChI

InChI=1S/C13H20N2O4S/c1-9-4-10(2)8-15(7-9)20(17,18)11-5-12(14-6-11)13(16)19-3/h5-6,9-10,14H,4,7-8H2,1-3H3