4-[(3,5-dimethylphenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(3,5-dimethylanilino)-5-nitro-phthalonitrile CAS Name: 4-(3,5-dimethylanilino)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(3,5-dimethylanilino)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(3,5-dimethylanilino)-5-nitro-phthalonitrile Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C16H12N4O2/c1-10-3-11(2)5-14(4-10)19-15-6-12(8-17)13(9-18)7-16(15)20(21)22/h3-7,19H,1-2H3