1-cyclopropyl-4-(3-oxidanylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxylic acid

Systemtic Name: 1-cyclopropyl-4-(3-oxidanylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxylic acid Openeye Name: 1-cyclopropyl-4-[(3-hydroxy-1-piperidyl)sulfonyl]pyrrole-2-carboxylic acid CAS Name: 1-cyclopropyl-4-[(3-hydroxy-1-piperidinyl)sulfonyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-cyclopropyl-4-(3-hydroxypiperidin-1-yl)sulfonylpyrrole-2-carboxylic acid Traditional Name: 1-cyclopropyl-4-(3-hydroxypiperidino)sulfonyl-pyrrole-2-carboxylic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CN(C(=C2)C(=O)O)C3CC3)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CN(C(=C2)C(=O)O)C3CC3)O

InChI

InChI=1S/C13H18N2O5S/c16-10-2-1-5-14(7-10)21(19,20)11-6-12(13(17)18)15(8-11)9-3-4-9/h6,8-10,16H,1-5,7H2,(H,17,18)