3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(NC(=C2C)C(=O)O)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(NC(=C2C)C(=O)O)C

InChI

InChI=1S/C13H20N2O4S/c1-8-4-6-15(7-5-8)20(18,19)12-9(2)11(13(16)17)14-10(12)3/h8,14H,4-7H2,1-3H3,(H,16,17)