N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]adamantan-2-amine hydrochloride

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]adamantan-2-amine hydrochloride Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]adamantan-2-amine hydrochloride CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-adamantanamine hydrochloride IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]adamantan-2-amine hydrochloride Traditional Name: 2-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)CNC2C3CC4CC(C3)CC2C4)OCC5=CC=CC=C5.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2C3CC4CC(C3)CC2C4)OCC5=CC=CC=C5.Cl

InChI

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