3-methyl-5-(phenylsulfamoyl)-2-piperidin-1-yl-benzoic acid

Systemtic Name: 3-methyl-5-(phenylsulfamoyl)-2-piperidin-1-yl-benzoic acid Openeye Name: 3-methyl-5-(phenylsulfamoyl)-2-(1-piperidyl)benzoic acid CAS Name: 3-methyl-5-(phenylsulfamoyl)-2-(1-piperidinyl)benzoic acid IUPAC Name: 3-methyl-5-(phenylsulfamoyl)-2-piperidin-1-ylbenzoic acid Traditional Name: 3-methyl-5-(phenylsulfamoyl)-2-piperidino-benzoic acid Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)S(=O)(=O)NC2=CC=CC=C2)C(=O)O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=CC(=C1)S(=O)(=O)NC2=CC=CC=C2)C(=O)O)N3CCCCC3

InChI

InChI=1S/C19H22N2O4S/c1-14-12-16(26(24,25)20-15-8-4-2-5-9-15)13-17(19(22)23)18(14)21-10-6-3-7-11-21/h2,4-5,8-9,12-13,20H,3,6-7,10-11H2,1H3,(H,22,23)