N-[[5-bromanyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl]heptan-1-amine hydrochloride

Systemtic Name: N-[[5-bromanyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl]heptan-1-amine hydrochloride Openeye Name: N-[[5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl]heptan-1-amine hydrochloride CAS Name: N-[[5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1-heptanamine hydrochloride IUPAC Name: N-[[5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl]heptan-1-amine hydrochloride Traditional Name: [5-bromo-2-(4-fluorobenzyl)oxy-benzyl]-heptyl-amine hydrochloride Formula: C21H28BrClFNO MolecularWeight: 444.808523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)F.Cl

Isomeric SMILES

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)F.Cl

InChI

InChI=1S/C21H27BrFNO.ClH/c1-2-3-4-5-6-13-24-15-18-14-19(22)9-12-21(18)25-16-17-7-10-20(23)11-8-17;/h7-12,14,24H,2-6,13,15-16H2,1H3;1H