N-[4-[(2-methylphenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-[(2-methylphenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide Openeye Name: 3,5-dinitro-N-[4-(o-tolylcarbamoyl)phenyl]benzamide CAS Name: N-[4-[(2-methylanilino)-oxomethyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-[(2-methylphenyl)carbamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-[4-(o-tolylcarbamoyl)phenyl]benzamide Formula: C21H16N4O6 MolecularWeight: 420.37494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O6/c1-13-4-2-3-5-19(13)23-20(26)14-6-8-16(9-7-14)22-21(27)15-10-17(24(28)29)12-18(11-15)25(30)31/h2-12H,1H3,(H,22,27)(H,23,26)