5-chloranyl-2-fluoranyl-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 5-chloranyl-2-fluoranyl-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 5-chloro-2-fluoro-3-[(4-hydroxy-1-piperidyl)sulfonyl]benzoic acid CAS Name: 5-chloro-2-fluoro-3-[(4-hydroxy-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 5-chloro-2-fluoro-3-(4-hydroxypiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 5-chloro-2-fluoro-3-(4-hydroxypiperidino)sulfonyl-benzoic acid Formula: C12H13ClFNO5S MolecularWeight: 337.751723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)S(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)F

Isomeric SMILES

C1CN(CCC1O)S(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)F

InChI

InChI=1S/C12H13ClFNO5S/c13-7-5-9(12(17)18)11(14)10(6-7)21(19,20)15-3-1-8(16)2-4-15/h5-6,8,16H,1-4H2,(H,17,18)