2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-3-[1-(phenylmethyl)pyridin-1-ium-4-yl]propanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-3-[1-(phenylmethyl)pyridin-1-ium-4-yl]propanenitrile Openeye Name: 3-(1-benzylpyridin-1-ium-4-yl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-propanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-3-[1-(phenylmethyl)-4-pyridin-1-iumyl]propanenitrile IUPAC Name: 3-(1-benzylpyridin-1-ium-4-yl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxopropanenitrile Traditional Name: 3-(1-benzylpyridin-1-ium-4-yl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-propionitrile Formula: C22H17N4O+ MolecularWeight: 353.39658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C(=O)C(=C3NC4=CC=CC=C4N3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C(=O)C(=C3NC4=CC=CC=C4N3)C#N

InChI

InChI=1S/C22H16N4O/c23-14-18(22-24-19-8-4-5-9-20(19)25-22)21(27)17-10-12-26(13-11-17)15-16-6-2-1-3-7-16/h1-13,27H,15H2/p+1