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

Systemtic Name: 4-[(4-ethanoylphenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-acetylanilino)-5-nitro-phthalonitrile CAS Name: 4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(4-acetylanilino)-5-nitro-phthalonitrile Formula: C16H10N4O3 MolecularWeight: 306.2756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N4O3/c1-10(21)11-2-4-14(5-3-11)19-15-6-12(8-17)13(9-18)7-16(15)20(22)23/h2-7,19H,1H3