[(1S)-1-(2-bromanyl-4,5-dimethoxy-phenyl)butyl]azanium

Systemtic Name: [(1S)-1-(2-bromanyl-4,5-dimethoxy-phenyl)butyl]azanium Openeye Name: [(1S)-1-(2-bromo-4,5-dimethoxy-phenyl)butyl]ammonium CAS Name: [(1S)-1-(2-bromo-4,5-dimethoxyphenyl)butyl]ammonium IUPAC Name: [(1S)-1-(2-bromo-4,5-dimethoxyphenyl)butyl]azanium Traditional Name: [(1S)-1-(2-bromo-4,5-dimethoxy-phenyl)butyl]ammonium Formula: C12H19BrNO2+ MolecularWeight: 289.18876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=C(C=C1Br)OC)OC)[NH3+]

Isomeric SMILES

CCC[C@@H](C1=CC(=C(C=C1Br)OC)OC)[NH3+]

InChI

InChI=1S/C12H18BrNO2/c1-4-5-10(14)8-6-11(15-2)12(16-3)7-9(8)13/h6-7,10H,4-5,14H2,1-3H3/p+1/t10-/m0/s1