2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: 2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: 2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: 2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: 2-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H29NO3 MolecularWeight: 355.47056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3C4CC5CC(C4)CC3C5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3C4CC5CC(C4)CC3C5)OC

InChI

InChI=1S/C22H29NO3/c1-25-19-10-15-3-4-23(12-18(15)11-20(19)26-2)22(24)21-16-6-13-5-14(8-16)9-17(21)7-13/h10-11,13-14,16-17,21H,3-9,12H2,1-2H3