[5-bromanyl-2-[(2-chlorophenyl)methoxy]phenyl]methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: [5-bromanyl-2-[(2-chlorophenyl)methoxy]phenyl]methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: [5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl-[(2S)-2-hydroxy-2-phenylethyl]ammonium IUPAC Name: [5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl-[(2S)-2-hydroxy-2-phenylethyl]azanium Traditional Name: [5-bromo-2-(2-chlorobenzyl)oxy-benzyl]-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C22H22BrClNO2+ MolecularWeight: 447.77258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3Cl)O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3Cl)O

InChI

InChI=1S/C22H21BrClNO2/c23-19-10-11-22(27-15-17-8-4-5-9-20(17)24)18(12-19)13-25-14-21(26)16-6-2-1-3-7-16/h1-12,21,25-26H,13-15H2/p+1/t21-/m1/s1