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

Systemtic Name: 3-(2,6-dimethylpiperidin-1-yl)sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 3-[(2,6-dimethyl-1-piperidyl)sulfonyl]-4-fluoro-benzoic acid CAS Name: 3-[(2,6-dimethyl-1-piperidinyl)sulfonyl]-4-fluorobenzoic acid IUPAC Name: 3-(2,6-dimethylpiperidin-1-yl)sulfonyl-4-fluorobenzoic acid Traditional Name: 3-(2,6-dimethylpiperidino)sulfonyl-4-fluoro-benzoic acid Formula: C14H18FNO4S MolecularWeight: 315.360423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18FNO4S/c1-9-4-3-5-10(2)16(9)21(19,20)13-8-11(14(17)18)6-7-12(13)15/h6-10H,3-5H2,1-2H3,(H,17,18)