4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-pyrrole-2-carboxylic acid Openeye Name: 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-1-ethyl-pyrrole-2-carboxylic acid CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-1-ethyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethylpyrrole-2-carboxylic acid Traditional Name: 4-(3,5-dimethylpiperidino)sulfonyl-1-ethyl-pyrrole-2-carboxylic acid Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CC(CC(C2)C)C

Isomeric SMILES

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CC(CC(C2)C)C

InChI

InChI=1S/C14H22N2O4S/c1-4-15-9-12(6-13(15)14(17)18)21(19,20)16-7-10(2)5-11(3)8-16/h6,9-11H,4-5,7-8H2,1-3H3,(H,17,18)