2-[4-azanyl-2,6-bis(bromanyl)phenoxy]ethyl-dimethyl-(3-oxidanylidenebutyl)azanium

Systemtic Name: 2-[4-azanyl-2,6-bis(bromanyl)phenoxy]ethyl-dimethyl-(3-oxidanylidenebutyl)azanium Openeye Name: 2-(4-amino-2,6-dibromo-phenoxy)ethyl-dimethyl-(3-oxobutyl)ammonium CAS Name: 2-(4-amino-2,6-dibromophenoxy)ethyl-dimethyl-(3-oxobutyl)ammonium IUPAC Name: 2-(4-amino-2,6-dibromophenoxy)ethyl-dimethyl-(3-oxobutyl)azanium Traditional Name: 2-(4-amino-2,6-dibromo-phenoxy)ethyl-(3-ketobutyl)-dimethyl-ammonium Formula: C14H21Br2N2O2+ MolecularWeight: 409.13674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC[N+](C)(C)CCOC1=C(C=C(C=C1Br)N)Br

Isomeric SMILES

CC(=O)CC[N+](C)(C)CCOC1=C(C=C(C=C1Br)N)Br

InChI

InChI=1S/C14H21Br2N2O2/c1-10(19)4-5-18(2,3)6-7-20-14-12(15)8-11(17)9-13(14)16/h8-9H,4-7,17H2,1-3H3/q+1