2-[(1-methylpiperidin-4-yl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 2-[(1-methylpiperidin-4-yl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 2-[(1-methyl-4-piperidyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 2-[(1-methyl-4-piperidinyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 2-[(1-methylpiperidin-4-yl)amino]-5-sulfamoylbenzoic acid Traditional Name: 2-[(1-methyl-4-piperidyl)amino]-5-sulfamoyl-benzoic acid Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C13H19N3O4S/c1-16-6-4-9(5-7-16)15-12-3-2-10(21(14,19)20)8-11(12)13(17)18/h2-3,8-9,15H,4-7H2,1H3,(H,17,18)(H2,14,19,20)