5-fluoranyl-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid

Systemtic Name: 5-fluoranyl-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid Openeye Name: 5-fluoro-2-[(3-methyl-1-piperidyl)sulfonylamino]benzoic acid CAS Name: 5-fluoro-2-[(3-methyl-1-piperidinyl)sulfonylamino]benzoic acid IUPAC Name: 5-fluoro-2-[(3-methylpiperidin-1-yl)sulfonylamino]benzoic acid Traditional Name: 5-fluoro-2-[(3-methylpiperidino)sulfonylamino]benzoic acid Formula: C13H17FN2O4S MolecularWeight: 316.348483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)F)C(=O)O

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)NC2=C(C=C(C=C2)F)C(=O)O

InChI

InChI=1S/C13H17FN2O4S/c1-9-3-2-6-16(8-9)21(19,20)15-12-5-4-10(14)7-11(12)13(17)18/h4-5,7,9,15H,2-3,6,8H2,1H3,(H,17,18)