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

Systemtic Name: 1-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: 1-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 1-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: 1-adamantyl-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: 1-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)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C22H29NO3/c1-25-19-8-17-3-4-23(13-18(17)9-20(19)26-2)21(24)22-10-14-5-15(11-22)7-16(6-14)12-22/h8-9,14-16H,3-7,10-13H2,1-2H3