3-[(2-methylpiperidin-1-yl)sulfonylmethyl]benzoic acid

Systemtic Name: 3-[(2-methylpiperidin-1-yl)sulfonylmethyl]benzoic acid Openeye Name: 3-[(2-methyl-1-piperidyl)sulfonylmethyl]benzoic acid CAS Name: 3-[(2-methyl-1-piperidinyl)sulfonylmethyl]benzoic acid IUPAC Name: 3-[(2-methylpiperidin-1-yl)sulfonylmethyl]benzoic acid Traditional Name: 3-[(2-methylpiperidino)sulfonylmethyl]benzoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1CCCCN1S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H19NO4S/c1-11-5-2-3-8-15(11)20(18,19)10-12-6-4-7-13(9-12)14(16)17/h4,6-7,9,11H,2-3,5,8,10H2,1H3,(H,16,17)