3-cyano-N-[4-nitro-2-(phenylcarbonyl)phenyl]benzamide

Systemtic Name: 3-cyano-N-[4-nitro-2-(phenylcarbonyl)phenyl]benzamide Openeye Name: N-(2-benzoyl-4-nitro-phenyl)-3-cyano-benzamide CAS Name: N-(2-benzoyl-4-nitrophenyl)-3-cyanobenzamide IUPAC Name: N-(2-benzoyl-4-nitrophenyl)-3-cyanobenzamide Traditional Name: N-(2-benzoyl-4-nitro-phenyl)-3-cyano-benzamide Formula: C21H13N3O4 MolecularWeight: 371.34562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H13N3O4/c22-13-14-5-4-8-16(11-14)21(26)23-19-10-9-17(24(27)28)12-18(19)20(25)15-6-2-1-3-7-15/h1-12H,(H,23,26)