2-[[2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-7-phenylmethoxy-isoquinolin-3-yl]methyl]-5H-isoindole-1,3,4-trione

Systemtic Name: 2-[[2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-7-phenylmethoxy-isoquinolin-3-yl]methyl]-5H-isoindole-1,3,4-trione Openeye Name: 2-[(7-benzyloxy-2-isobutyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-5H-isoindole-1,3,4-trione CAS Name: 2-[[2-(2-methylpropyl)-1-oxo-4-phenyl-7-phenylmethoxy-3-isoquinolinyl]methyl]-5H-isoindole-1,3,4-trione IUPAC Name: 2-[[2-(2-methylpropyl)-1-oxo-4-phenyl-7-phenylmethoxyisoquinolin-3-yl]methyl]-5H-isoindole-1,3,4-trione Traditional Name: 2-[(7-benzoxy-2-isobutyl-1-keto-4-phenyl-3-isoquinolyl)methyl]-5H-isoindole-1,3,4-trione Formula: C35H30N2O5 MolecularWeight: 558.6231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C4=CC=CC=C4)CN5C(=O)C6=C(C5=O)C(=O)CC=C6

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C4=CC=CC=C4)CN5C(=O)C6=C(C5=O)C(=O)CC=C6

InChI

InChI=1S/C35H30N2O5/c1-22(2)19-36-29(20-37-33(39)27-14-9-15-30(38)32(27)35(37)41)31(24-12-7-4-8-13-24)26-17-16-25(18-28(26)34(36)40)42-21-23-10-5-3-6-11-23/h3-14,16-18,22H,15,19-21H2,1-2H3