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

Systemtic Name: 1-adamantyl-[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: 1-adamantyl-[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: 1-adamantyl-[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: 1-adamantyl-[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: 1-adamantyl-[1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C28H32ClNO3 MolecularWeight: 466.01158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC(=CC=C6)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC(=CC=C6)Cl)OC

InChI

InChI=1S/C28H32ClNO3/c1-32-24-12-20-6-7-30(27(31)28-14-17-8-18(15-28)10-19(9-17)16-28)26(23(20)13-25(24)33-2)21-4-3-5-22(29)11-21/h3-5,11-13,17-19,26H,6-10,14-16H2,1-2H3