4-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: 4-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate Openeye Name: 4-[[(2S)-2-(2-hydroxyethyl)-1-piperidyl]sulfonyl]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[(2S)-2-(2-hydroxyethyl)-1-piperidinyl]sulfonyl]-1-methyl-2-pyrrolecarboxylate IUPAC Name: 4-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-[(2S)-2-(2-hydroxyethyl)piperidino]sulfonyl-1-methyl-pyrrole-2-carboxylate Formula: C13H19N2O5S- MolecularWeight: 315.36536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N2CCCCC2CCO

Isomeric SMILES

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N2CCCC[C@H]2CCO

InChI

InChI=1S/C13H20N2O5S/c1-14-9-11(8-12(14)13(17)18)21(19,20)15-6-3-2-4-10(15)5-7-16/h8-10,16H,2-7H2,1H3,(H,17,18)/p-1/t10-/m0/s1