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

Systemtic Name: methyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium Openeye Name: methyl-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]-(2-phenoxyethyl)ammonium CAS Name: methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]-(2-phenoxyethyl)ammonium IUPAC Name: methyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]-(2-phenoxyethyl)azanium Traditional Name: [2-keto-2-(3-mesylanilino)ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C18H23N2O4S+ MolecularWeight: 363.45122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4S/c1-20(11-12-24-16-8-4-3-5-9-16)14-18(21)19-15-7-6-10-17(13-15)25(2,22)23/h3-10,13H,11-12,14H2,1-2H3,(H,19,21)/p+1