2-methoxy-5-(3-methylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 2-methoxy-5-(3-methylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 2-methoxy-5-[(3-methyl-1-piperidyl)sulfonyl]benzoic acid CAS Name: 2-methoxy-5-[(3-methyl-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 2-methoxy-5-(3-methylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 2-methoxy-5-(3-methylpiperidino)sulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-10-4-3-7-15(9-10)21(18,19)11-5-6-13(20-2)12(8-11)14(16)17/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,16,17)