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

Systemtic Name: 1-adamantyl-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: 1-adamantyl-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: 1-adamantyl-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: 1-adamantyl-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: 1-adamantyl-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C30H37NO5 MolecularWeight: 491.61848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C3=CC(=C(C=C3CCN2C(=O)C45CC6CC(C4)CC(C6)C5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C3=CC(=C(C=C3CCN2C(=O)C45CC6CC(C4)CC(C6)C5)OC)OC)OC

InChI

InChI=1S/C30H37NO5/c1-33-24-6-5-22(13-25(24)34-2)28-23-14-27(36-4)26(35-3)12-21(23)7-8-31(28)29(32)30-15-18-9-19(16-30)11-20(10-18)17-30/h5-6,12-14,18-20,28H,7-11,15-17H2,1-4H3