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

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]octan-1-amine hydrochloride Openeye Name: N-[[3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl]octan-1-amine hydrochloride CAS Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-octanamine hydrochloride IUPAC Name: N-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]octan-1-amine hydrochloride Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-octyl-amine hydrochloride Formula: C24H35BrClNO2 MolecularWeight: 484.8972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C)OC.Cl

Isomeric SMILES

CCCCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C)OC.Cl

InChI

InChI=1S/C24H34BrNO2.ClH/c1-4-5-6-7-8-9-14-26-17-21-15-22(25)24(23(16-21)27-3)28-18-20-12-10-19(2)11-13-20;/h10-13,15-16,26H,4-9,14,17-18H2,1-3H3;1H