2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitropyrazol-1-yl)-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-3-keto-butyronitrile Formula: C16H14N6O3 MolecularWeight: 338.32076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O3/c1-9-15(22(24)25)10(2)21(20-9)8-14(23)11(7-17)16-18-12-5-3-4-6-13(12)19-16/h3-6,18-19H,8H2,1-2H3