[2-(diethylamino)-2-oxidanylidene-ethyl]-[(4-nitrophenyl)methyl]-dipropyl-azanium bromide

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl]-[(4-nitrophenyl)methyl]-dipropyl-azanium bromide Openeye Name: [2-(diethylamino)-2-oxo-ethyl]-[(4-nitrophenyl)methyl]-dipropyl-ammonium bromide CAS Name: [2-(diethylamino)-2-oxoethyl]-[(4-nitrophenyl)methyl]-dipropylammonium bromide IUPAC Name: [2-(diethylamino)-2-oxoethyl]-[(4-nitrophenyl)methyl]-dipropylazanium bromide Traditional Name: [2-(diethylamino)-2-keto-ethyl]-(4-nitrobenzyl)-dipropyl-ammonium bromide Formula: C19H32BrN3O3 MolecularWeight: 430.37968

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)N(CC)CC.[Br-]

Isomeric SMILES

CCC[N+](CCC)(CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)N(CC)CC.[Br-]

InChI

InChI=1S/C19H32N3O3.BrH/c1-5-13-22(14-6-2,16-19(23)20(7-3)8-4)15-17-9-11-18(12-10-17)21(24)25;/h9-12H,5-8,13-16H2,1-4H3;1H/q+1;/p-1