2-[4-[3-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[4-[3-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]ethanoic acid Openeye Name: 2-[4-[[3-(hydroxymethyl)-1-piperidyl]sulfonyl]phenyl]acetic acid CAS Name: 2-[4-[[3-(hydroxymethyl)-1-piperidinyl]sulfonyl]phenyl]acetic acid IUPAC Name: 2-[4-[3-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]acetic acid Traditional Name: 2-[4-(3-methylolpiperidino)sulfonylphenyl]acetic acid Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)O)CO

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)O)CO

InChI

InChI=1S/C14H19NO5S/c16-10-12-2-1-7-15(9-12)21(19,20)13-5-3-11(4-6-13)8-14(17)18/h3-6,12,16H,1-2,7-10H2,(H,17,18)