3-[(4-bromanyl-2-chloranyl-phenyl)carbamoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-bromanyl-2-chloranyl-phenyl)carbamoylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-bromo-2-chloro-phenyl)carbamoylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-bromo-2-chloroanilino)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-bromo-2-chlorophenyl)carbamoylamino]propyl-dimethylazanium Traditional Name: 3-[(4-bromo-2-chloro-phenyl)carbamoylamino]propyl-dimethyl-ammonium Formula: C12H18BrClN3O+ MolecularWeight: 335.64782

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)NC1=C(C=C(C=C1)Br)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)NC1=C(C=C(C=C1)Br)Cl

InChI

InChI=1S/C12H17BrClN3O/c1-17(2)7-3-6-15-12(18)16-11-5-4-9(13)8-10(11)14/h4-5,8H,3,6-7H2,1-2H3,(H2,15,16,18)/p+1