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

Systemtic Name: 1-ethyl-4-(3-oxidanylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxylic acid Openeye Name: 1-ethyl-4-[(3-hydroxy-1-piperidyl)sulfonyl]pyrrole-2-carboxylic acid CAS Name: 1-ethyl-4-[(3-hydroxy-1-piperidinyl)sulfonyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-ethyl-4-(3-hydroxypiperidin-1-yl)sulfonylpyrrole-2-carboxylic acid Traditional Name: 1-ethyl-4-(3-hydroxypiperidino)sulfonyl-pyrrole-2-carboxylic acid Formula: C12H18N2O5S MolecularWeight: 302.34672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CCCC(C2)O

Isomeric SMILES

CCN1C=C(C=C1C(=O)O)S(=O)(=O)N2CCCC(C2)O

InChI

InChI=1S/C12H18N2O5S/c1-2-13-8-10(6-11(13)12(16)17)20(18,19)14-5-3-4-9(15)7-14/h6,8-9,15H,2-5,7H2,1H3,(H,16,17)