2-[5-oxidanyl-6-(phenylmethoxymethyl)-4-prop-2-enoxy-2-thiophen-2-yloxy-oxan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-oxidanyl-6-(phenylmethoxymethyl)-4-prop-2-enoxy-2-thiophen-2-yloxy-oxan-3-yl]isoindole-1,3-dione Openeye Name: 2-[4-allyloxy-6-(benzyloxymethyl)-5-hydroxy-2-(2-thienyloxy)tetrahydropyran-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-hydroxy-6-(phenylmethoxymethyl)-4-prop-2-enoxy-2-thiophen-2-yloxy-3-oxanyl]isoindole-1,3-dione IUPAC Name: 2-[5-hydroxy-6-(phenylmethoxymethyl)-4-prop-2-enoxy-2-thiophen-2-yloxyoxan-3-yl]isoindole-1,3-dione Traditional Name: 2-[4-allyloxy-6-(benzoxymethyl)-5-hydroxy-2-(2-thienyloxy)tetrahydropyran-3-yl]isoindoline-1,3-quinone Formula: C28H27NO7S MolecularWeight: 521.58148

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1C(C(OC(C1O)COCC2=CC=CC=C2)OC3=CC=CS3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C=CCOC1C(C(OC(C1O)COCC2=CC=CC=C2)OC3=CC=CS3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H27NO7S/c1-2-14-34-25-23(29-26(31)19-11-6-7-12-20(19)27(29)32)28(36-22-13-8-15-37-22)35-21(24(25)30)17-33-16-18-9-4-3-5-10-18/h2-13,15,21,23-25,28,30H,1,14,16-17H2