N-[4-methyl-2-(phenylcarbonyl)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-methyl-2-(phenylcarbonyl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-(2-benzoyl-4-methyl-phenyl)-3,5-dinitro-benzamide CAS Name: N-(2-benzoyl-4-methylphenyl)-3,5-dinitrobenzamide IUPAC Name: N-(2-benzoyl-4-methylphenyl)-3,5-dinitrobenzamide Traditional Name: N-(2-benzoyl-4-methyl-phenyl)-3,5-dinitro-benzamide Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H15N3O6/c1-13-7-8-19(18(9-13)20(25)14-5-3-2-4-6-14)22-21(26)15-10-16(23(27)28)12-17(11-15)24(29)30/h2-12H,1H3,(H,22,26)