7-[[2-(1-adamantylcarbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-chromen-2-one

Systemtic Name: 7-[[2-(1-adamantylcarbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-chromen-2-one Openeye Name: 7-[[2-(adamantane-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-chromen-2-one CAS Name: 7-[[2-[1-adamantyl(oxo)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[[2-(adamantane-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methylchromen-2-one Traditional Name: 7-[[2-(adamantane-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-coumarin Formula: C33H37NO6 MolecularWeight: 543.64998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=O)C56CC7CC(C5)CC(C7)C6)OC)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=O)C56CC7CC(C5)CC(C7)C6)OC)OC

InChI

InChI=1S/C33H37NO6/c1-19-8-31(35)40-28-13-24(4-5-25(19)28)39-18-27-26-14-30(38-3)29(37-2)12-23(26)6-7-34(27)32(36)33-15-20-9-21(16-33)11-22(10-20)17-33/h4-5,8,12-14,20-22,27H,6-7,9-11,15-18H2,1-3H3