[4-[[2-(4-chlorophenyl)sulfonylethanoylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[2-(4-chlorophenyl)sulfonylethanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[[2-(4-chlorophenyl)sulfonylacetyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[2-(4-chlorophenyl)sulfonyl-1-oxoethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[[2-(4-chlorophenyl)sulfonylacetyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[2-(4-chlorophenyl)sulfonylacetyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C20H26ClN2O3S+ MolecularWeight: 409.95004

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H25ClN2O3S/c1-3-23(4-2)14-17-7-5-16(6-8-17)13-22-20(24)15-27(25,26)19-11-9-18(21)10-12-19/h5-12H,3-4,13-15H2,1-2H3,(H,22,24)/p+1