N,N-diethyl-3,5-dinitro-2-(2-oxidanylidenepropyl)benzamide

Systemtic Name: N,N-diethyl-3,5-dinitro-2-(2-oxidanylidenepropyl)benzamide Openeye Name: 2-acetonyl-N,N-diethyl-3,5-dinitro-benzamide CAS Name: N,N-diethyl-3,5-dinitro-2-(2-oxopropyl)benzamide IUPAC Name: N,N-diethyl-3,5-dinitro-2-(2-oxopropyl)benzamide Traditional Name: 2-acetonyl-N,N-diethyl-3,5-dinitro-benzamide Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC(=C1CC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC(=C1CC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c1-4-15(5-2)14(19)12-7-10(16(20)21)8-13(17(22)23)11(12)6-9(3)18/h7-8H,4-6H2,1-3H3