(3-azaniumyl-2-oxidanyl-propyl)-(2-bromophenyl)azanium dichloride

Systemtic Name: (3-azaniumyl-2-oxidanyl-propyl)-(2-bromophenyl)azanium dichloride Openeye Name: (3-azaniumyl-2-hydroxy-propyl)-(2-bromophenyl)ammonium dichloride CAS Name: (3-ammonio-2-hydroxypropyl)-(2-bromophenyl)ammonium dichloride IUPAC Name: (3-azaniumyl-2-hydroxypropyl)-(2-bromophenyl)azanium dichloride Traditional Name: (3-ammonio-2-hydroxy-propyl)-(2-bromophenyl)ammonium dichloride Formula: C9H15BrCl2N2O MolecularWeight: 318.0382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[NH2+]CC(C[NH3+])O)Br.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C(=C1)[NH2+]CC(C[NH3+])O)Br.[Cl-].[Cl-]

InChI

InChI=1S/C9H13BrN2O.2ClH/c10-8-3-1-2-4-9(8)12-6-7(13)5-11;;/h1-4,7,12-13H,5-6,11H2;2*1H