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

Systemtic Name: 2-azanylidene-3-(4-methylphenyl)-4-(4-methylphenyl)imino-5a-oxidanyl-10-oxidanylidene-5H-indeno[1,2-d]azepine-1-carbonitrile Openeye Name: 5a-hydroxy-2-imino-10-oxo-3-(p-tolyl)-4-(p-tolylimino)-5H-indeno[1,2-d]azepine-1-carbonitrile CAS Name: 5a-hydroxy-2-imino-3-(4-methylphenyl)-4-(4-methylphenyl)imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile IUPAC Name: 5a-hydroxy-2-imino-3-(4-methylphenyl)-4-(4-methylphenyl)imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile Traditional Name: 5a-hydroxy-2-imino-10-keto-3-(p-tolyl)-4-(p-tolylimino)-5H-inden[1,2-d]azepine-1-carbonitrile Formula: C28H22N4O2 MolecularWeight: 446.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2CC3(C4=CC=CC=C4C(=O)C3=C(C(=N)N2C5=CC=C(C=C5)C)C#N)O

Isomeric SMILES

CC1=CC=C(C=C1)N=C2CC3(C4=CC=CC=C4C(=O)C3=C(C(=N)N2C5=CC=C(C=C5)C)C#N)O

InChI

InChI=1S/C28H22N4O2/c1-17-7-11-19(12-8-17)31-24-15-28(34)23-6-4-3-5-21(23)26(33)25(28)22(16-29)27(30)32(24)20-13-9-18(2)10-14-20/h3-14,30,34H,15H2,1-2H3