3-(3-hydroxyphenyl)-2-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]propanoate

Systemtic Name: 3-(3-hydroxyphenyl)-2-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]propanoate Openeye Name: 2-(1-hydroxy-2,5-dioxo-pyrrolidin-1-ium-1-yl)-3-(3-hydroxyphenyl)propanoate CAS Name: 2-(1-hydroxy-2,5-dioxo-1-pyrrolidin-1-iumyl)-3-(3-hydroxyphenyl)propanoate IUPAC Name: 2-(1-hydroxy-2,5-dioxopyrrolidin-1-ium-1-yl)-3-(3-hydroxyphenyl)propanoate Traditional Name: 2-(1-hydroxy-2,5-diketo-pyrrolidin-1-ium-1-yl)-3-(3-hydroxyphenyl)propionate Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)[N+](C1=O)(C(CC2=CC(=CC=C2)O)C(=O)[O-])O

Isomeric SMILES

C1CC(=O)[N+](C1=O)(C(CC2=CC(=CC=C2)O)C(=O)[O-])O

InChI

InChI=1S/C13H13NO6/c15-9-3-1-2-8(6-9)7-10(13(18)19)14(20)11(16)4-5-12(14)17/h1-3,6,10,20H,4-5,7H2,(H-,15,18,19)