2-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phthalazin-1-one

Systemtic Name: 2-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phthalazin-1-one Openeye Name: 2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phthalazin-1-one CAS Name: 2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1-phthalazinone IUPAC Name: 2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phthalazin-1-one Traditional Name: 2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phthalazin-1-one Formula: C20H21N3O4 MolecularWeight: 367.39844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C20H21N3O4/c1-26-17-7-8-18(27-2)19-15(17)10-22(11-16(19)24)12-23-20(25)14-6-4-3-5-13(14)9-21-23/h3-9,16,24H,10-12H2,1-2H3