(4-cyano-2-fluoranyl-phenyl)methyl-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-cyano-2-fluoro-phenyl)methyl-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-cyano-2-fluorophenyl)methyl-[2-(2,3-dimethylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (4-cyano-2-fluorophenyl)methyl-[2-(2,3-dimethylanilino)-2-oxoethyl]-methylazanium Traditional Name: (4-cyano-2-fluoro-benzyl)-[2-(2,3-dimethylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C19H21FN3O+ MolecularWeight: 326.387943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C[NH+](C)CC2=C(C=C(C=C2)C#N)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C[NH+](C)CC2=C(C=C(C=C2)C#N)F)C

InChI

InChI=1S/C19H20FN3O/c1-13-5-4-6-18(14(13)2)22-19(24)12-23(3)11-16-8-7-15(10-21)9-17(16)20/h4-9H,11-12H2,1-3H3,(H,22,24)/p+1