2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-1-(2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-1-(2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-1-indolin-1-yl-ethanone CAS Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxyphenoxy]-1-(2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxyphenoxy]-1-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[4-[(2-adamantylamino)methyl]-2-methoxy-phenoxy]-1-indolin-1-yl-ethanone Formula: C28H34N2O3 MolecularWeight: 446.58116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2C3CC4CC(C3)CC2C4)OCC(=O)N5CCC6=CC=CC=C65

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2C3CC4CC(C3)CC2C4)OCC(=O)N5CCC6=CC=CC=C65

InChI

InChI=1S/C28H34N2O3/c1-32-26-15-18(16-29-28-22-11-19-10-20(13-22)14-23(28)12-19)6-7-25(26)33-17-27(31)30-9-8-21-4-2-3-5-24(21)30/h2-7,15,19-20,22-23,28-29H,8-14,16-17H2,1H3