(2E,3E)-3-(3-bromanyl-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile

Systemtic Name: (2E,3E)-3-(3-bromanyl-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile Openeye Name: (2E,3E)-3-(3-bromo-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile CAS Name: (2E,3E)-3-(3-bromo-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile IUPAC Name: (2E,3E)-3-(3-bromo-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile Traditional Name: (2E,3E)-3-(3-bromo-4-keto-5-nitro-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propionitrile Formula: C17H11BrN4O3 MolecularWeight: 399.19824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C(C=C3C=C(C(=O)C(=C3)Br)[N+](=O)[O-])C#N)N2

Isomeric SMILES

CC1=CC2=C(C=C1)N/C(=C(/C=C/3\C=C(C(=O)C(=C3)Br)[N+](=O)[O-])\C#N)/N2

InChI

InChI=1S/C17H11BrN4O3/c1-9-2-3-13-14(4-9)21-17(20-13)11(8-19)5-10-6-12(18)16(23)15(7-10)22(24)25/h2-7,20-21H,1H3/b10-5-,17-11+