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

Systemtic Name: 2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-ethoxy-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-ethoxy-phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-4-ethoxyphenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-ethoxyphenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-ethoxy-benzyl]isoindoline-1,3-quinone Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H24N2O4/c1-2-33-24-12-11-18(16-29-26(31)21-9-5-6-10-22(21)27(29)32)15-23(24)25(30)28-14-13-19-7-3-4-8-20(19)17-28/h3-12,15H,2,13-14,16-17H2,1H3