3-[4-[2,3-bis(oxidanyl)propoxy]phenyl]pyrrole-2,5-dione

Systemtic Name: 3-[4-[2,3-bis(oxidanyl)propoxy]phenyl]pyrrole-2,5-dione Openeye Name: 3-[4-(2,3-dihydroxypropoxy)phenyl]pyrrole-2,5-dione CAS Name: 3-[4-(2,3-dihydroxypropoxy)phenyl]pyrrole-2,5-dione IUPAC Name: 3-[4-(2,3-dihydroxypropoxy)phenyl]pyrrole-2,5-dione Traditional Name: 3-(4-glyceryloxyphenyl)-3-pyrroline-2,5-quinone Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=O)NC2=O)OCC(CO)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=O)NC2=O)OCC(CO)O

InChI

InChI=1S/C13H13NO5/c15-6-9(16)7-19-10-3-1-8(2-4-10)11-5-12(17)14-13(11)18/h1-5,9,15-16H,6-7H2,(H,14,17,18)