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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)N(C)C3=CC=CC=C3

Isomeric SMILES

CC1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)N(C)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O4S/c1-13-8-9-22(12-13)16-10-14(19(23)24)11-17(27(20,25)26)18(16)21(2)15-6-4-3-5-7-15/h3-7,10-11,13H,8-9,12H2,1-2H3,(H,23,24)(H2,20,25,26)