8-[1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[1-[(1,3-dioxoisoindolin-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[1-[(1,3-dioxo-2-isoindolyl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[1-[(1,3-dioxoisoindol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-[1-(phthalimidomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-7H-purine-2,6-quinone Formula: C25H22N6O4 MolecularWeight: 470.47998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C25H22N6O4/c1-28-20-19(23(34)29(2)25(28)35)26-24(27-20)30-12-11-14-7-3-4-8-15(14)18(30)13-31-21(32)16-9-5-6-10-17(16)22(31)33/h3-10,18H,11-13H2,1-2H3,(H,26,27)