3-chloranyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzoic acid

Systemtic Name: 3-chloranyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzoic acid Openeye Name: 3-chloro-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzoic acid CAS Name: 3-chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorobenzoic acid IUPAC Name: 3-chloro-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzoic acid Traditional Name: 3-chloro-5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-benzoic acid Formula: C14H17ClFNO4S MolecularWeight: 349.805483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)F)Cl)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)F)Cl)C

InChI

InChI=1S/C14H17ClFNO4S/c1-8-3-9(2)7-17(6-8)22(20,21)10-4-11(14(18)19)13(16)12(15)5-10/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,19)