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

Systemtic Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-3,5-dinitro-benzamide Openeye Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-3,5-dinitro-benzamide CAS Name: N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-N-methyl-3,5-dinitrobenzamide IUPAC Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-3,5-dinitrobenzamide Traditional Name: N-[4-(cyclopropylcarbamoyl)benzyl]-N-methyl-3,5-dinitro-benzamide Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O6/c1-21(11-12-2-4-13(5-3-12)18(24)20-15-6-7-15)19(25)14-8-16(22(26)27)10-17(9-14)23(28)29/h2-5,8-10,15H,6-7,11H2,1H3,(H,20,24)