2-[(3,5-dinitrophenyl)carbonylamino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[(3,5-dinitrophenyl)carbonylamino]ethyl-diethyl-azanium chloride Openeye Name: 2-[(3,5-dinitrobenzoyl)amino]ethyl-diethyl-ammonium chloride CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]ethyl-diethylammonium chloride IUPAC Name: 2-[(3,5-dinitrobenzoyl)amino]ethyl-diethylazanium chloride Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]ethyl-diethyl-ammonium chloride Formula: C13H19ClN4O5 MolecularWeight: 346.76676

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H18N4O5.ClH/c1-3-15(4-2)6-5-14-13(18)10-7-11(16(19)20)9-12(8-10)17(21)22;/h7-9H,3-6H2,1-2H3,(H,14,18);1H