N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]adamantan-1-amine hydrochloride

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]adamantan-1-amine hydrochloride Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]adamantan-1-amine hydrochloride CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-adamantanamine hydrochloride IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]adamantan-1-amine hydrochloride Traditional Name: 1-adamantyl-(4-benzoxy-3-methoxy-benzyl)amine hydrochloride Formula: C25H32ClNO2 MolecularWeight: 413.98008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)OCC5=CC=CC=C5.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)OCC5=CC=CC=C5.Cl

InChI

InChI=1S/C25H31NO2.ClH/c1-27-24-12-19(7-8-23(24)28-17-18-5-3-2-4-6-18)16-26-25-13-20-9-21(14-25)11-22(10-20)15-25;/h2-8,12,20-22,26H,9-11,13-17H2,1H3;1H