2-(1,3-dimethylbenzimidazol-2-ylidene)-2-(2,4,6-trinitrophenyl)ethanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-2-(2,4,6-trinitrophenyl)ethanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-2-(2,4,6-trinitrophenyl)acetonitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-2-(2,4,6-trinitrophenyl)acetonitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-2-(2,4,6-trinitrophenyl)acetonitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-2-picryl-acetonitrile Formula: C17H12N6O6 MolecularWeight: 396.31378

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C17H12N6O6/c1-19-12-5-3-4-6-13(12)20(2)17(19)11(9-18)16-14(22(26)27)7-10(21(24)25)8-15(16)23(28)29/h3-8H,1-2H3