2-(2,2-dimethylpiperidin-1-yl)sulfonylbenzoic acid

Systemtic Name: 2-(2,2-dimethylpiperidin-1-yl)sulfonylbenzoic acid Openeye Name: 2-[(2,2-dimethyl-1-piperidyl)sulfonyl]benzoic acid CAS Name: 2-[(2,2-dimethyl-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 2-(2,2-dimethylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 2-(2,2-dimethylpiperidino)sulfonylbenzoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCN1S(=O)(=O)C2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1(CCCCN1S(=O)(=O)C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C14H19NO4S/c1-14(2)9-5-6-10-15(14)20(18,19)12-8-4-3-7-11(12)13(16)17/h3-4,7-8H,5-6,9-10H2,1-2H3,(H,16,17)