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

Systemtic Name: N-[(3-methoxy-4-phenethyloxy-phenyl)methyl]adamantan-1-amine Openeye Name: N-[(3-methoxy-4-phenethyloxy-phenyl)methyl]adamantan-1-amine CAS Name: N-[(3-methoxy-4-phenethyloxyphenyl)methyl]-1-adamantanamine IUPAC Name: N-[(3-methoxy-4-phenethyloxyphenyl)methyl]adamantan-1-amine Traditional Name: 1-adamantyl-(3-methoxy-4-phenethyloxy-benzyl)amine Formula: C26H33NO2 MolecularWeight: 391.54572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)OCCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)OCCC5=CC=CC=C5

InChI

InChI=1S/C26H33NO2/c1-28-25-14-20(7-8-24(25)29-10-9-19-5-3-2-4-6-19)18-27-26-15-21-11-22(16-26)13-23(12-21)17-26/h2-8,14,21-23,27H,9-13,15-18H2,1H3