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

Systemtic Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-(dimethylamino)-2-methoxy-5-nitrophenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitrobenzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-(dimethylamino)-2-methoxy-5-nitro-benzoyl]amino]ethyl-diethyl-ammonium Formula: C16H27N4O4+ MolecularWeight: 339.40998

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O4/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)/p+1