[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-methyl-azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-methyl-azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-methyl-ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-methylammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-methylazanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-methyl-ammonium Formula: C10H15BrNO+ MolecularWeight: 245.1362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]C

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+]C

InChI

InChI=1S/C10H14BrNO/c1-3-9(12-2)8-6-7(11)4-5-10(8)13/h4-6,9,12-13H,3H2,1-2H3/p+1/t9-/m0/s1