N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-1-phenyl-methanamine hydrochloride

Systemtic Name: N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-1-phenyl-methanamine hydrochloride Openeye Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-1-phenyl-methanamine hydrochloride CAS Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-phenylmethanamine hydrochloride IUPAC Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-phenylmethanamine hydrochloride Traditional Name: benzyl-[3-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-benzyl]amine hydrochloride Formula: C22H22BrClFNO2 MolecularWeight: 466.770983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC2=CC=CC=C2)Br)OCC3=CC=C(C=C3)F.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCC2=CC=CC=C2)Br)OCC3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C22H21BrFNO2.ClH/c1-26-21-12-18(14-25-13-16-5-3-2-4-6-16)11-20(23)22(21)27-15-17-7-9-19(24)10-8-17;/h2-12,25H,13-15H2,1H3;1H