2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzyl]isoindoline-1,3-quinone Formula: C25H20N2O3 MolecularWeight: 396.4379

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H20N2O3/c28-23(26-13-12-18-7-1-2-8-20(18)16-26)19-9-5-6-17(14-19)15-27-24(29)21-10-3-4-11-22(21)25(27)30/h1-11,14H,12-13,15-16H2