2-[[2-(dibutylamino)-2-oxidanylidene-ethyl]-(4-nitrophenyl)carbonyl-amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-(dibutylamino)-2-oxidanylidene-ethyl]-(4-nitrophenyl)carbonyl-amino]ethyl-diethyl-azanium Openeye Name: 2-[[2-(dibutylamino)-2-oxo-ethyl]-(4-nitrobenzoyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-(dibutylamino)-2-oxoethyl]-[(4-nitrophenyl)-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-(dibutylamino)-2-oxoethyl]-(4-nitrobenzoyl)amino]ethyl-diethylazanium Traditional Name: 2-[[2-(dibutylamino)-2-keto-ethyl]-(4-nitrobenzoyl)amino]ethyl-diethyl-ammonium Formula: C23H39N4O4+ MolecularWeight: 435.58016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN(CC[NH+](CC)CC)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)C(=O)CN(CC[NH+](CC)CC)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C23H38N4O4/c1-5-9-15-25(16-10-6-2)22(28)19-26(18-17-24(7-3)8-4)23(29)20-11-13-21(14-12-20)27(30)31/h11-14H,5-10,15-19H2,1-4H3/p+1