2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]isoindole-1,3-dione

Systemtic Name: 2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]isoindole-1,3-dione Openeye Name: 2-[3-methyl-3-phenyl-1-[4-(2-quinolylmethoxy)phenyl]butoxy]isoindoline-1,3-dione CAS Name: 2-[3-methyl-3-phenyl-1-[4-(2-quinolinylmethoxy)phenyl]butoxy]isoindole-1,3-dione IUPAC Name: 2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]isoindole-1,3-dione Traditional Name: 2-[3-methyl-3-phenyl-1-[4-(2-quinolylmethoxy)phenyl]butoxy]isoindoline-1,3-quinone Formula: C35H30N2O4 MolecularWeight: 542.6237

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)ON4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6

Isomeric SMILES

CC(C)(CC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)ON4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6

InChI

InChI=1S/C35H30N2O4/c1-35(2,26-11-4-3-5-12-26)22-32(41-37-33(38)29-13-7-8-14-30(29)34(37)39)25-17-20-28(21-18-25)40-23-27-19-16-24-10-6-9-15-31(24)36-27/h3-21,32H,22-23H2,1-2H3