2-chloranyl-5-(2,4-dimethylpiperidin-1-yl)sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 2-chloranyl-5-(2,4-dimethylpiperidin-1-yl)sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 2-chloro-5-[(2,4-dimethyl-1-piperidyl)sulfonyl]-4-fluoro-benzoic acid CAS Name: 2-chloro-5-[(2,4-dimethyl-1-piperidinyl)sulfonyl]-4-fluorobenzoic acid IUPAC Name: 2-chloro-5-(2,4-dimethylpiperidin-1-yl)sulfonyl-4-fluorobenzoic acid Traditional Name: 2-chloro-5-(2,4-dimethylpiperidino)sulfonyl-4-fluoro-benzoic acid Formula: C14H17ClFNO4S MolecularWeight: 349.805483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C1)C)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)F

Isomeric SMILES

CC1CCN(C(C1)C)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)F

InChI

InChI=1S/C14H17ClFNO4S/c1-8-3-4-17(9(2)5-8)22(20,21)13-6-10(14(18)19)11(15)7-12(13)16/h6-9H,3-5H2,1-2H3,(H,18,19)