2-azanylidene-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-5a-oxidanyl-10-oxidanylidene-5H-indeno[1,2-d]azepine-1-carbonitrile

Systemtic Name: 2-azanylidene-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-5a-oxidanyl-10-oxidanylidene-5H-indeno[1,2-d]azepine-1-carbonitrile Openeye Name: 5a-hydroxy-2-imino-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile CAS Name: 5a-hydroxy-2-imino-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile IUPAC Name: 5a-hydroxy-2-imino-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile Traditional Name: 5a-hydroxy-2-imino-10-keto-3-(4-nitrophenyl)-4-(4-nitrophenyl)imino-5H-inden[1,2-d]azepine-1-carbonitrile Formula: C26H16N6O6 MolecularWeight: 508.44184

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=C(C=C2)[N+](=O)[O-])N(C(=N)C(=C3C1(C4=CC=CC=C4C3=O)O)C#N)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C(=NC2=CC=C(C=C2)[N+](=O)[O-])N(C(=N)C(=C3C1(C4=CC=CC=C4C3=O)O)C#N)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H16N6O6/c27-14-20-23-24(33)19-3-1-2-4-21(19)26(23,34)13-22(29-15-5-7-17(8-6-15)31(35)36)30(25(20)28)16-9-11-18(12-10-16)32(37)38/h1-12,28,34H,13H2