2-[(1-methylquinolin-1-ium-4-yl)methylidene]propanedinitrile tetrafluoroborate

Systemtic Name: 2-[(1-methylquinolin-1-ium-4-yl)methylidene]propanedinitrile tetrafluoroborate Openeye Name: 2-[(1-methylquinolin-1-ium-4-yl)methylene]propanedinitrile tetrafluoroborate CAS Name: 2-[(1-methyl-4-quinolin-1-iumyl)methylidene]propanedinitrile tetrafluoroborate IUPAC Name: 2-[(1-methylquinolin-1-ium-4-yl)methylidene]propanedinitrile tetrafluoroborate Traditional Name: 2-[(1-methylquinolin-1-ium-4-yl)methylene]malononitrile tetrafluoroborate Formula: C14H10BF4N3 MolecularWeight: 307.053913

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CC=C(C2=CC=CC=C21)C=C(C#N)C#N

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CC=C(C2=CC=CC=C21)C=C(C#N)C#N

InChI

InChI=1S/C14H10N3.BF4/c1-17-7-6-12(8-11(9-15)10-16)13-4-2-3-5-14(13)17;2-1(3,4)5/h2-8H,1H3;/q+1;-1