3-[2-[(3-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(3-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-[N-(benzenesulfonyl)-3-chloro-anilino]acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[N-(benzenesulfonyl)-3-chloroanilino]-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-[N-(benzenesulfonyl)-3-chloroanilino]acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(N-besyl-3-chloro-anilino)acetyl]amino]propyl-dimethyl-ammonium Formula: C19H25ClN3O3S+ MolecularWeight: 410.9381

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCCNC(=O)CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H24ClN3O3S/c1-22(2)13-7-12-21-19(24)15-23(17-9-6-8-16(20)14-17)27(25,26)18-10-4-3-5-11-18/h3-6,8-11,14H,7,12-13,15H2,1-2H3,(H,21,24)/p+1