2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxyphenoxy]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxyphenoxy]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-N-(p-tolyl)acetamide Formula: C27H34N2O3 MolecularWeight: 434.57046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CNC3C4CC5CC(C4)CC3C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CNC3C4CC5CC(C4)CC3C5)OC

InChI

InChI=1S/C27H34N2O3/c1-17-3-6-23(7-4-17)29-26(30)16-32-24-8-5-18(14-25(24)31-2)15-28-27-21-10-19-9-20(12-21)13-22(27)11-19/h3-8,14,19-22,27-28H,9-13,15-16H2,1-2H3,(H,29,30)