[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C15H21BrN3O+ MolecularWeight: 339.25074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]CCCN2C=CN=C2

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C15H20BrN3O/c1-2-14(13-10-12(16)4-5-15(13)20)18-6-3-8-19-9-7-17-11-19/h4-5,7,9-11,14,18,20H,2-3,6,8H2,1H3/p+1/t14-/m0/s1