3-(2-methylpiperidin-1-yl)sulfonylbenzoic acid

Systemtic Name: 3-(2-methylpiperidin-1-yl)sulfonylbenzoic acid Openeye Name: 3-[(2-methyl-1-piperidyl)sulfonyl]benzoic acid CAS Name: 3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 3-(2-methylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 3-(2-methylpiperidino)sulfonylbenzoic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4S/c1-10-5-2-3-8-14(10)19(17,18)12-7-4-6-11(9-12)13(15)16/h4,6-7,9-10H,2-3,5,8H2,1H3,(H,15,16)