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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

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