2-nitro-4-(4-nitrophenyl)carbonyl-benzenecarbonitrile

Systemtic Name: 2-nitro-4-(4-nitrophenyl)carbonyl-benzenecarbonitrile Openeye Name: 2-nitro-4-(4-nitrobenzoyl)benzonitrile CAS Name: 2-nitro-4-[(4-nitrophenyl)-oxomethyl]benzonitrile IUPAC Name: 2-nitro-4-(4-nitrobenzoyl)benzonitrile Traditional Name: 2-nitro-4-(4-nitrobenzoyl)benzonitrile Formula: C14H7N3O5 MolecularWeight: 297.22248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC(=C(C=C2)C#N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC(=C(C=C2)C#N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H7N3O5/c15-8-11-2-1-10(7-13(11)17(21)22)14(18)9-3-5-12(6-4-9)16(19)20/h1-7H