diethyl-[2-(methylamino)-2-oxidanylidene-ethyl]-[(4-nitrophenyl)methyl]azanium bromide

Systemtic Name: diethyl-[2-(methylamino)-2-oxidanylidene-ethyl]-[(4-nitrophenyl)methyl]azanium bromide Openeye Name: diethyl-[2-(methylamino)-2-oxo-ethyl]-[(4-nitrophenyl)methyl]ammonium bromide CAS Name: diethyl-[2-(methylamino)-2-oxoethyl]-[(4-nitrophenyl)methyl]ammonium bromide IUPAC Name: diethyl-[2-(methylamino)-2-oxoethyl]-[(4-nitrophenyl)methyl]azanium bromide Traditional Name: diethyl-[2-keto-2-(methylamino)ethyl]-(4-nitrobenzyl)ammonium bromide Formula: C14H22BrN3O3 MolecularWeight: 360.24678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3.BrH/c1-4-17(5-2,11-14(18)15-3)10-12-6-8-13(9-7-12)16(19)20;/h6-9H,4-5,10-11H2,1-3H3;1H