[(2R)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-(2-hydroxyethyl)-(phenylmethyl)azanium

Systemtic Name: [(2R)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-(2-hydroxyethyl)-(phenylmethyl)azanium Openeye Name: benzyl-[(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-(2-hydroxyethyl)ammonium CAS Name: [(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2R)-3-(4-bromophenoxy)-2-hydroxypropyl]-(2-hydroxyethyl)azanium Traditional Name: benzyl-[(2R)-3-(4-bromophenoxy)-2-hydroxy-propyl]-(2-hydroxyethyl)ammonium Formula: C18H23BrNO3+ MolecularWeight: 381.28412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrNO3/c19-16-6-8-18(9-7-16)23-14-17(22)13-20(10-11-21)12-15-4-2-1-3-5-15/h1-9,17,21-22H,10-14H2/p+1/t17-/m1/s1