(E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-6-nitro-2-oxidanylidene-benzimidazol-5-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-6-nitro-2-oxidanylidene-benzimidazol-5-yl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-6-nitro-2-oxo-benzimidazol-5-yl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-6-nitro-2-oxo-5-benzimidazolyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-6-nitro-2-oxobenzimidazol-5-yl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-keto-1,3-dimethyl-6-nitro-benzimidazol-5-yl)acrylonitrile Formula: C19H14N6O3 MolecularWeight: 374.35286

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C(=C2)C=C(C#N)C3=NC4=CC=CC=C4N3)[N+](=O)[O-])N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C(=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4N3)[N+](=O)[O-])N(C1=O)C

InChI

InChI=1S/C19H14N6O3/c1-23-16-8-11(15(25(27)28)9-17(16)24(2)19(23)26)7-12(10-20)18-21-13-5-3-4-6-14(13)22-18/h3-9H,1-2H3,(H,21,22)/b12-7+