[(1R)-2-azaniumyl-1-(3-bromanyl-4-propoxy-phenyl)ethyl]-diethyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(3-bromanyl-4-propoxy-phenyl)ethyl]-diethyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(3-bromo-4-propoxy-phenyl)ethyl]-diethyl-ammonium CAS Name: [(1R)-2-ammonio-1-(3-bromo-4-propoxyphenyl)ethyl]-diethylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(3-bromo-4-propoxyphenyl)ethyl]-diethylazanium Traditional Name: [(1R)-2-ammonio-1-(3-bromo-4-propoxy-phenyl)ethyl]-diethyl-ammonium Formula: C15H27BrN2O+2 MolecularWeight: 331.29168

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+](CC)CC)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+](CC)CC)Br

InChI

InChI=1S/C15H25BrN2O/c1-4-9-19-15-8-7-12(10-13(15)16)14(11-17)18(5-2)6-3/h7-8,10,14H,4-6,9,11,17H2,1-3H3/p+2/t14-/m0/s1