3-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[(5-bromo-2-chloro-benzoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(5-bromo-2-chlorophenyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(5-bromo-2-chlorobenzoyl)amino]propyl-dimethylazanium Traditional Name: 3-[(5-bromo-2-chloro-benzoyl)amino]propyl-dimethyl-ammonium Formula: C12H17BrClN2O+ MolecularWeight: 320.63318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=C(C=CC(=C1)Br)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=C(C=CC(=C1)Br)Cl

InChI

InChI=1S/C12H16BrClN2O/c1-16(2)7-3-6-15-12(17)10-8-9(13)4-5-11(10)14/h4-5,8H,3,6-7H2,1-2H3,(H,15,17)/p+1