[2-[[2-[(3-chlorophenyl)-methylsulfonyl-amino]ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[2-[(3-chlorophenyl)-methylsulfonyl-amino]ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[2-(3-chloro-N-methylsulfonyl-anilino)acetyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[2-(3-chloro-N-methylsulfonylanilino)-1-oxoethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[2-(3-chloro-N-methylsulfonylanilino)acetyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[2-(3-chloro-N-mesyl-anilino)acetyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C19H25ClN3O3S+ MolecularWeight: 410.9381

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H24ClN3O3S/c1-22(2)13-16-8-5-4-7-15(16)12-21-19(24)14-23(27(3,25)26)18-10-6-9-17(20)11-18/h4-11H,12-14H2,1-3H3,(H,21,24)/p+1