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

Systemtic Name: N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]butan-1-amine hydrochloride Openeye Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]butan-1-amine hydrochloride CAS Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-butanamine hydrochloride IUPAC Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]butan-1-amine hydrochloride Traditional Name: [3-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-benzyl]-butyl-amine hydrochloride Formula: C19H24BrClFNO2 MolecularWeight: 432.754763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)F)OC.Cl

Isomeric SMILES

CCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)F)OC.Cl

InChI

InChI=1S/C19H23BrFNO2.ClH/c1-3-4-9-22-12-15-10-17(20)19(18(11-15)23-2)24-13-14-5-7-16(21)8-6-14;/h5-8,10-11,22H,3-4,9,12-13H2,1-2H3;1H