2-[4-[(2R)-3-(4-methylphenoxy)-2-oxidanyl-propoxy]phenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[(2R)-3-(4-methylphenoxy)-2-oxidanyl-propoxy]phenyl]isoindole-1,3-dione Openeye Name: 2-[4-[(2R)-2-hydroxy-3-(4-methylphenoxy)propoxy]phenyl]isoindoline-1,3-dione CAS Name: 2-[4-[(2R)-2-hydroxy-3-(4-methylphenoxy)propoxy]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(2R)-2-hydroxy-3-(4-methylphenoxy)propoxy]phenyl]isoindole-1,3-dione Traditional Name: 2-[4-[(2R)-2-hydroxy-3-(4-methylphenoxy)propoxy]phenyl]isoindoline-1,3-quinone Formula: C24H21NO5 MolecularWeight: 403.42724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OC[C@H](COC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C24H21NO5/c1-16-6-10-19(11-7-16)29-14-18(26)15-30-20-12-8-17(9-13-20)25-23(27)21-4-2-3-5-22(21)24(25)28/h2-13,18,26H,14-15H2,1H3/t18-/m1/s1