methyl 4-(3-methylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(3-methylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[(3-methyl-1-piperidyl)sulfonyl]-1H-pyrrole-2-carboxylate CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-methylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(3-methylpiperidino)sulfonyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OC

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OC

InChI

InChI=1S/C12H18N2O4S/c1-9-4-3-5-14(8-9)19(16,17)10-6-11(13-7-10)12(15)18-2/h6-7,9,13H,3-5,8H2,1-2H3