2-(4-chlorophenyl)sulfonylethyl-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(4-chlorophenyl)sulfonylethyl-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-(4-chlorophenyl)sulfonylethyl-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(4-chlorophenyl)sulfonylethyl-[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2-(4-chlorophenyl)sulfonylethyl-[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: 2-(4-chlorophenyl)sulfonylethyl-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C21H28ClN2O5S+ MolecularWeight: 455.97542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CCS(=O)(=O)C2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CCS(=O)(=O)C2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C21H27ClN2O5S/c1-4-28-19-11-8-17(14-20(19)29-5-2)23-21(25)15-24(3)12-13-30(26,27)18-9-6-16(22)7-10-18/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,25)/p+1