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

Systemtic Name: 7-[(2-cyclopentylcarbonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]-4-methyl-chromen-2-one Openeye Name: 7-[[2-(cyclopentanecarbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-chromen-2-one CAS Name: 7-[[2-[cyclopentyl(oxo)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[[2-(cyclopentanecarbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methylchromen-2-one Traditional Name: 7-[[2-(cyclopentanecarbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]-4-methyl-coumarin Formula: C28H31NO6 MolecularWeight: 477.54884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=O)C5CCCC5)OC)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=O)C5CCCC5)OC)OC

InChI

InChI=1S/C28H31NO6/c1-17-12-27(30)35-24-14-20(8-9-21(17)24)34-16-23-22-15-26(33-3)25(32-2)13-19(22)10-11-29(23)28(31)18-6-4-5-7-18/h8-9,12-15,18,23H,4-7,10-11,16H2,1-3H3