4-[methyl(phenyl)amino]-3-piperidin-1-yl-5-sulfamoyl-benzoic acid

Systemtic Name: 4-[methyl(phenyl)amino]-3-piperidin-1-yl-5-sulfamoyl-benzoic acid Openeye Name: 4-(N-methylanilino)-3-(1-piperidyl)-5-sulfamoyl-benzoic acid CAS Name: 4-(N-methylanilino)-3-(1-piperidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-(N-methylanilino)-3-piperidin-1-yl-5-sulfamoylbenzoic acid Traditional Name: 4-(N-methylanilino)-3-piperidino-5-sulfamoyl-benzoic acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N3CCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1)C2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N3CCCCC3

InChI

InChI=1S/C19H23N3O4S/c1-21(15-8-4-2-5-9-15)18-16(22-10-6-3-7-11-22)12-14(19(23)24)13-17(18)27(20,25)26/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,23,24)(H2,20,25,26)