2-[[4-(dimethylamino)-2-methoxy-5-nitro-phenyl]carbonylamino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-phenyl]carbonylamino]ethyl-diethyl-azanium chloride Openeye Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-benzoyl]amino]ethyl-diethyl-ammonium chloride CAS Name: 2-[[[4-(dimethylamino)-2-methoxy-5-nitrophenyl]-oxomethyl]amino]ethyl-diethylammonium chloride IUPAC Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitrobenzoyl]amino]ethyl-diethylazanium chloride Traditional Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-benzoyl]amino]ethyl-diethyl-ammonium chloride Formula: C16H27ClN4O4 MolecularWeight: 374.86298

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC(=C(C=C1OC)N(C)C)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC(=C(C=C1OC)N(C)C)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H26N4O4.ClH/c1-6-19(7-2)9-8-17-16(21)12-10-14(20(22)23)13(18(3)4)11-15(12)24-5;/h10-11H,6-9H2,1-5H3,(H,17,21);1H