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

Systemtic Name: N-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]adamantan-2-amine hydrochloride Openeye Name: N-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]adamantan-2-amine hydrochloride CAS Name: N-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-2-adamantanamine hydrochloride IUPAC Name: N-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]adamantan-2-amine hydrochloride Traditional Name: 2-adamantyl-[2-(4-chlorobenzyl)oxy-3-methoxy-benzyl]amine hydrochloride Formula: C25H31Cl2NO2 MolecularWeight: 448.42514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC3C4CC5CC(C4)CC3C5.Cl

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC3C4CC5CC(C4)CC3C5.Cl

InChI

InChI=1S/C25H30ClNO2.ClH/c1-28-23-4-2-3-19(25(23)29-15-16-5-7-22(26)8-6-16)14-27-24-20-10-17-9-18(12-20)13-21(24)11-17;/h2-8,17-18,20-21,24,27H,9-15H2,1H3;1H