[3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-[(2R)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-[(2R)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-[(2R)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-[(2R)-2-hydroxy-2-phenylethyl]ammonium IUPAC Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-[(2R)-2-hydroxy-2-phenylethyl]azanium Traditional Name: [3-bromo-5-ethoxy-4-(4-fluorobenzyl)oxy-benzyl]-[(2R)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C24H26BrFNO3+ MolecularWeight: 475.370543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC(C2=CC=CC=C2)O)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]C[C@@H](C2=CC=CC=C2)O)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H25BrFNO3/c1-2-29-23-13-18(14-27-15-22(28)19-6-4-3-5-7-19)12-21(25)24(23)30-16-17-8-10-20(26)11-9-17/h3-13,22,27-28H,2,14-16H2,1H3/p+1/t22-/m0/s1