3-(2,6-dimethylpiperidin-1-yl)sulfonyl-4-methyl-benzoic acid

Systemtic Name: 3-(2,6-dimethylpiperidin-1-yl)sulfonyl-4-methyl-benzoic acid Openeye Name: 3-[(2,6-dimethyl-1-piperidyl)sulfonyl]-4-methyl-benzoic acid CAS Name: 3-[(2,6-dimethyl-1-piperidinyl)sulfonyl]-4-methylbenzoic acid IUPAC Name: 3-(2,6-dimethylpiperidin-1-yl)sulfonyl-4-methylbenzoic acid Traditional Name: 3-(2,6-dimethylpiperidino)sulfonyl-4-methyl-benzoic acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C)C

InChI

InChI=1S/C15H21NO4S/c1-10-7-8-13(15(17)18)9-14(10)21(19,20)16-11(2)5-4-6-12(16)3/h7-9,11-12H,4-6H2,1-3H3,(H,17,18)