2-(4-chloranylphenoxy)ethyl-methyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-methyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]ammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[2-keto-2-(3-mesylanilino)ethyl]-methyl-ammonium Formula: C18H22ClN2O4S+ MolecularWeight: 397.89628

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=C(C=C1)Cl)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

C[NH+](CCOC1=CC=C(C=C1)Cl)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H21ClN2O4S/c1-21(10-11-25-16-8-6-14(19)7-9-16)13-18(22)20-15-4-3-5-17(12-15)26(2,23)24/h3-9,12H,10-11,13H2,1-2H3,(H,20,22)/p+1