(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl-[(4-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: (5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl-[(4-fluorophenyl)methyl]-methyl-azanium Openeye Name: (5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl-[(4-fluorophenyl)methyl]-methyl-ammonium CAS Name: (5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl-[(4-fluorophenyl)methyl]-methylammonium IUPAC Name: (5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-[(4-fluorophenyl)methyl]-methylazanium Traditional Name: (5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl-(4-fluorobenzyl)-methyl-ammonium Formula: C16H18FN4O+ MolecularWeight: 301.338723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(C=C2)F)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C16H17FN4O/c1-11-12(2)19-21(16(22)15(11)8-18)10-20(3)9-13-4-6-14(17)7-5-13/h4-7H,9-10H2,1-3H3/p+1