N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3,5-dinitro-benzamide

Systemtic Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3,5-dinitro-benzamide Openeye Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3,5-dinitro-benzamide CAS Name: N-cyclopropyl-N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-3,5-dinitrobenzamide IUPAC Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3,5-dinitrobenzamide Traditional Name: N-cyclopropyl-N-[4-(cyclopropylcarbamoyl)benzyl]-3,5-dinitro-benzamide Formula: C21H20N4O6 MolecularWeight: 424.4067

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O6/c26-20(22-16-5-6-16)14-3-1-13(2-4-14)12-23(17-7-8-17)21(27)15-9-18(24(28)29)11-19(10-15)25(30)31/h1-4,9-11,16-17H,5-8,12H2,(H,22,26)