4-[(3-nitrophenyl)-[(3-nitrophenyl)diazenyl]amino]butanenitrile

Systemtic Name: 4-[(3-nitrophenyl)-[(3-nitrophenyl)diazenyl]amino]butanenitrile Openeye Name: 4-(3-nitro-N-(3-nitrophenyl)azo-anilino)butanenitrile CAS Name: 4-(3-nitro-N-(3-nitrophenyl)azoanilino)butanenitrile IUPAC Name: 4-(3-nitro-N-[(3-nitrophenyl)diazenyl]anilino)butanenitrile Traditional Name: 4-(3-nitro-N-(3-nitrophenyl)azo-anilino)butyronitrile Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N=NN(CCCC#N)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N=NN(CCCC#N)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O4/c17-9-1-2-10-20(14-6-4-8-16(12-14)22(25)26)19-18-13-5-3-7-15(11-13)21(23)24/h3-8,11-12H,1-2,10H2