5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-(4-ethoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-(4-ethoxyphenyl)isoindole-1,3-dione Openeye Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-(4-ethoxyphenyl)isoindoline-1,3-dione CAS Name: 5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-(4-ethoxyphenyl)isoindole-1,3-dione IUPAC Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-(4-ethoxyphenyl)isoindole-1,3-dione Traditional Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-p-phenetyl-isoindoline-1,3-quinone Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H22N2O4/c1-2-32-21-10-8-20(9-11-21)28-25(30)22-12-7-18(15-23(22)26(28)31)24(29)27-14-13-17-5-3-4-6-19(17)16-27/h3-12,15H,2,13-14,16H2,1H3