[(2R)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(2R)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C15H21BrN3O2+ MolecularWeight: 355.25014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(C[NH2+]CCCN2C=CN=C2)O)Br

Isomeric SMILES

C1=CC(=CC=C1OC[C@@H](C[NH2+]CCCN2C=CN=C2)O)Br

InChI

InChI=1S/C15H20BrN3O2/c16-13-2-4-15(5-3-13)21-11-14(20)10-17-6-1-8-19-9-7-18-12-19/h2-5,7,9,12,14,17,20H,1,6,8,10-11H2/p+1/t14-/m1/s1