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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=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)21(27)23-16-8-6-15(7-9-16)22-20(26)14-10-17(24(28)29)12-18(11-14)25(30)31/h2-12H,1H3,(H,22,26)(H,23,27)