3-[4-(hydroxymethyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid

Systemtic Name: 3-[4-(hydroxymethyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid Openeye Name: 3-[[4-(hydroxymethyl)-1-piperidyl]sulfonyl]thiophene-2-carboxylic acid CAS Name: 3-[[4-(hydroxymethyl)-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[4-(hydroxymethyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid Traditional Name: 3-(4-methylolpiperidino)sulfonyl-2-thenoic acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)S(=O)(=O)C2=C(SC=C2)C(=O)O

Isomeric SMILES

C1CN(CCC1CO)S(=O)(=O)C2=C(SC=C2)C(=O)O

InChI

InChI=1S/C11H15NO5S2/c13-7-8-1-4-12(5-2-8)19(16,17)9-3-6-18-10(9)11(14)15/h3,6,8,13H,1-2,4-5,7H2,(H,14,15)