2-[6-(hydroxymethyl)-4,5-bis(oxidanyl)-2-thiophen-2-yloxy-oxan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[6-(hydroxymethyl)-4,5-bis(oxidanyl)-2-thiophen-2-yloxy-oxan-3-yl]isoindole-1,3-dione Openeye Name: 2-[4,5-dihydroxy-6-(hydroxymethyl)-2-(2-thienyloxy)tetrahydropyran-3-yl]isoindoline-1,3-dione CAS Name: 2-[4,5-dihydroxy-6-(hydroxymethyl)-2-thiophen-2-yloxy-3-oxanyl]isoindole-1,3-dione IUPAC Name: 2-[4,5-dihydroxy-6-(hydroxymethyl)-2-thiophen-2-yloxyoxan-3-yl]isoindole-1,3-dione Traditional Name: 2-[4,5-dihydroxy-6-methylol-2-(2-thienyloxy)tetrahydropyran-3-yl]isoindoline-1,3-quinone Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3C(C(C(OC3OC4=CC=CS4)CO)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3C(C(C(OC3OC4=CC=CS4)CO)O)O

InChI

InChI=1S/C18H17NO7S/c20-8-11-14(21)15(22)13(18(25-11)26-12-6-3-7-27-12)19-16(23)9-4-1-2-5-10(9)17(19)24/h1-7,11,13-15,18,20-22H,8H2