5-methyl-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid

Systemtic Name: 5-methyl-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid Openeye Name: 5-methyl-2-[(3-methyl-1-piperidyl)sulfonylamino]benzoic acid CAS Name: 5-methyl-2-[(3-methyl-1-piperidinyl)sulfonylamino]benzoic acid IUPAC Name: 5-methyl-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid Traditional Name: 5-methyl-2-[(3-methylpiperidino)sulfonylamino]benzoic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)C)C(=O)O

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)C)C(=O)O

InChI

InChI=1S/C14H20N2O4S/c1-10-5-6-13(12(8-10)14(17)18)15-21(19,20)16-7-3-4-11(2)9-16/h5-6,8,11,15H,3-4,7,9H2,1-2H3,(H,17,18)