2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(1-hexyl-6-methoxy-3,4-dihydroisoquinolin-5-yl)oxy]ethyl]isoindoline-1,3-quinone Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NCCC2=C1C=CC(=C2OCCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

CCCCCCC1=NCCC2=C1C=CC(=C2OCCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C26H30N2O4/c1-3-4-5-6-11-22-18-12-13-23(31-2)24(19(18)14-15-27-22)32-17-16-28-25(29)20-9-7-8-10-21(20)26(28)30/h7-10,12-13H,3-6,11,14-17H2,1-2H3