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

Systemtic Name: [(2R)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium Formula: C17H21BrNO2+ MolecularWeight: 351.25814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC(COC2=CC=C(C=C2)Br)O

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]C[C@H](COC2=CC=C(C=C2)Br)O

InChI

InChI=1S/C17H20BrNO2/c1-13(14-5-3-2-4-6-14)19-11-16(20)12-21-17-9-7-15(18)8-10-17/h2-10,13,16,19-20H,11-12H2,1H3/p+1/t13-,16-/m1/s1