[2-[[[5-(cyclopropylsulfamoyl)-2-methyl-phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[5-(cyclopropylsulfamoyl)-2-methyl-phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[5-(cyclopropylsulfamoyl)-2-methyl-benzoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[5-(cyclopropylsulfamoyl)-2-methylphenyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[5-(cyclopropylsulfamoyl)-2-methylbenzoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[5-(cyclopropylsulfamoyl)-2-methyl-benzoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCC3=CC=CC=C3C[NH+](C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCC3=CC=CC=C3C[NH+](C)C

InChI

InChI=1S/C21H27N3O3S/c1-15-8-11-19(28(26,27)23-18-9-10-18)12-20(15)21(25)22-13-16-6-4-5-7-17(16)14-24(2)3/h4-8,11-12,18,23H,9-10,13-14H2,1-3H3,(H,22,25)/p+1