azanyl-[2-(4-azanyl-3-bromanyl-phenyl)-2-oxidanylidene-ethyl]-diethyl-azanium chloride

Systemtic Name: azanyl-[2-(4-azanyl-3-bromanyl-phenyl)-2-oxidanylidene-ethyl]-diethyl-azanium chloride Openeye Name: amino-[2-(4-amino-3-bromo-phenyl)-2-oxo-ethyl]-diethyl-ammonium chloride CAS Name: amino-[2-(4-amino-3-bromophenyl)-2-oxoethyl]-diethylammonium chloride IUPAC Name: amino-[2-(4-amino-3-bromophenyl)-2-oxoethyl]-diethylazanium chloride Traditional Name: amino-[2-(4-amino-3-bromo-phenyl)-2-keto-ethyl]-diethyl-ammonium chloride Formula: C12H19BrClN3O MolecularWeight: 336.65576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18BrN3O.ClH/c1-3-16(15,4-2)8-12(17)9-5-6-11(14)10(13)7-9;/h5-7H,3-4,8,15H2,1-2H3,(H-,14,17);1H