[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [3-bromo-4-(2-fluorobenzyl)oxy-5-methoxy-benzyl]-[(1R)-1-phenylethyl]ammonium Formula: C23H24BrFNO2+ MolecularWeight: 445.344563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3F)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3F)OC

InChI

InChI=1S/C23H23BrFNO2/c1-16(18-8-4-3-5-9-18)26-14-17-12-20(24)23(22(13-17)27-2)28-15-19-10-6-7-11-21(19)25/h3-13,16,26H,14-15H2,1-2H3/p+1/t16-/m1/s1