[(1S)-2-azaniumyl-1-(5-bromanyl-2-oxidanyl-phenyl)ethyl]-cyclohexyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(5-bromanyl-2-oxidanyl-phenyl)ethyl]-cyclohexyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(5-bromo-2-hydroxy-phenyl)ethyl]-cyclohexyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(5-bromo-2-hydroxyphenyl)ethyl]-cyclohexyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(5-bromo-2-hydroxyphenyl)ethyl]-cyclohexyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(5-bromo-2-hydroxy-phenyl)ethyl]-cyclohexyl-methyl-ammonium Formula: C15H25BrN2O+2 MolecularWeight: 329.2758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C(C[NH3+])C2=C(C=CC(=C2)Br)O

Isomeric SMILES

C[NH+](C1CCCCC1)[C@H](C[NH3+])C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C15H23BrN2O/c1-18(12-5-3-2-4-6-12)14(10-17)13-9-11(16)7-8-15(13)19/h7-9,12,14,19H,2-6,10,17H2,1H3/p+2/t14-/m1/s1