[(1S)-1-(5-bromanyl-2-methoxy-phenyl)hexyl]azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-methoxy-phenyl)hexyl]azanium Openeye Name: [(1S)-1-(5-bromo-2-methoxy-phenyl)hexyl]ammonium CAS Name: [(1S)-1-(5-bromo-2-methoxyphenyl)hexyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-2-methoxyphenyl)hexyl]azanium Traditional Name: [(1S)-1-(5-bromo-2-methoxy-phenyl)hexyl]ammonium Formula: C13H21BrNO+ MolecularWeight: 287.21594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C=CC(=C1)Br)OC)[NH3+]

Isomeric SMILES

CCCCC[C@@H](C1=C(C=CC(=C1)Br)OC)[NH3+]

InChI

InChI=1S/C13H20BrNO/c1-3-4-5-6-12(15)11-9-10(14)7-8-13(11)16-2/h7-9,12H,3-6,15H2,1-2H3/p+1/t12-/m0/s1