2-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]benzenecarbonitrile

Systemtic Name: 2-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]benzenecarbonitrile Openeye Name: 2-[(4,5-dimethoxy-2-nitro-phenyl)methyleneamino]benzonitrile CAS Name: 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]benzonitrile IUPAC Name: 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]benzonitrile Traditional Name: 2-[(4,5-dimethoxy-2-nitro-benzylidene)amino]benzonitrile Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=NC2=CC=CC=C2C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=NC2=CC=CC=C2C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C16H13N3O4/c1-22-15-7-12(14(19(20)21)8-16(15)23-2)10-18-13-6-4-3-5-11(13)9-17/h3-8,10H,1-2H3