ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-(3-methylsulfonylanilino)-2-oxoethyl]ammonium IUPAC Name: ethyl-[(3-fluoro-4-methoxyphenyl)methyl]-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: ethyl-(3-fluoro-4-methoxy-benzyl)-[2-keto-2-(3-mesylanilino)ethyl]ammonium Formula: C19H24FN2O4S+ MolecularWeight: 395.468263

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H23FN2O4S/c1-4-22(12-14-8-9-18(26-2)17(20)10-14)13-19(23)21-15-6-5-7-16(11-15)27(3,24)25/h5-11H,4,12-13H2,1-3H3,(H,21,23)/p+1