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

Systemtic Name: 2-azanylidene-3-(4-chlorophenyl)-4-(4-chlorophenyl)imino-5a-oxidanyl-10-oxidanylidene-5H-indeno[1,2-d]azepine-1-carbonitrile Openeye Name: 3-(4-chlorophenyl)-4-(4-chlorophenyl)imino-5a-hydroxy-2-imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile CAS Name: 3-(4-chlorophenyl)-4-(4-chlorophenyl)imino-5a-hydroxy-2-imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile IUPAC Name: 3-(4-chlorophenyl)-4-(4-chlorophenyl)imino-5a-hydroxy-2-imino-10-oxo-5H-indeno[1,2-d]azepine-1-carbonitrile Traditional Name: 3-(4-chlorophenyl)-4-(4-chlorophenyl)imino-5a-hydroxy-2-imino-10-keto-5H-inden[1,2-d]azepine-1-carbonitrile Formula: C26H16Cl2N4O2 MolecularWeight: 487.33684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=C(C=C2)Cl)N(C(=N)C(=C3C1(C4=CC=CC=C4C3=O)O)C#N)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C(=NC2=CC=C(C=C2)Cl)N(C(=N)C(=C3C1(C4=CC=CC=C4C3=O)O)C#N)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H16Cl2N4O2/c27-15-5-9-17(10-6-15)31-22-13-26(34)21-4-2-1-3-19(21)24(33)23(26)20(14-29)25(30)32(22)18-11-7-16(28)8-12-18/h1-12,30,34H,13H2