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

Systemtic Name: N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]octan-1-amine hydrochloride Openeye Name: N-[(3-bromo-4,5-dimethoxy-phenyl)methyl]octan-1-amine hydrochloride CAS Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-1-octanamine hydrochloride IUPAC Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]octan-1-amine hydrochloride Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-octyl-amine hydrochloride Formula: C17H29BrClNO2 MolecularWeight: 394.77466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28BrNO2.ClH/c1-4-5-6-7-8-9-10-19-13-14-11-15(18)17(21-3)16(12-14)20-2;/h11-12,19H,4-10,13H2,1-3H3;1H