2-[2-methylsulfanyl-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-methylsulfanyl-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]isoindole-1,3-dione Openeye Name: 2-[4-benzyloxy-6-(benzyloxymethyl)-5-hydroxy-2-methylsulfanyl-tetrahydropyran-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-hydroxy-2-(methylthio)-4-phenylmethoxy-6-(phenylmethoxymethyl)-3-oxanyl]isoindole-1,3-dione IUPAC Name: 2-[5-hydroxy-2-methylsulfanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl]isoindole-1,3-dione Traditional Name: 2-[4-benzoxy-6-(benzoxymethyl)-5-hydroxy-2-(methylthio)tetrahydropyran-3-yl]isoindoline-1,3-quinone Formula: C29H29NO6S MolecularWeight: 519.60866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1C(C(C(C(O1)COCC2=CC=CC=C2)O)OCC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CSC1C(C(C(C(O1)COCC2=CC=CC=C2)O)OCC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C29H29NO6S/c1-37-29-24(30-27(32)21-14-8-9-15-22(21)28(30)33)26(35-17-20-12-6-3-7-13-20)25(31)23(36-29)18-34-16-19-10-4-2-5-11-19/h2-15,23-26,29,31H,16-18H2,1H3