N-[2-[(2,4-dinitrophenyl)carbonylamino]-4-methyl-phenyl]-2,4-dinitro-benzamide

Systemtic Name: N-[2-[(2,4-dinitrophenyl)carbonylamino]-4-methyl-phenyl]-2,4-dinitro-benzamide Openeye Name: N-[2-[(2,4-dinitrobenzoyl)amino]-4-methyl-phenyl]-2,4-dinitro-benzamide CAS Name: N-[2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-4-methylphenyl]-2,4-dinitrobenzamide IUPAC Name: N-[2-[(2,4-dinitrobenzoyl)amino]-4-methylphenyl]-2,4-dinitrobenzamide Traditional Name: N-[2-[(2,4-dinitrobenzoyl)amino]-4-methyl-phenyl]-2,4-dinitro-benzamide Formula: C21H14N6O10 MolecularWeight: 510.37006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N6O10/c1-11-2-7-16(22-20(28)14-5-3-12(24(30)31)9-18(14)26(34)35)17(8-11)23-21(29)15-6-4-13(25(32)33)10-19(15)27(36)37/h2-10H,1H3,(H,22,28)(H,23,29)