2,5-bis(oxidanylidene)-1-(2-oxidanyl-1-oxidanylidene-1-phenoxy-propan-2-yl)pyrrolidine-3-sulfonic acid

Systemtic Name: 2,5-bis(oxidanylidene)-1-(2-oxidanyl-1-oxidanylidene-1-phenoxy-propan-2-yl)pyrrolidine-3-sulfonic acid Openeye Name: 1-(1-hydroxy-1-methyl-2-oxo-2-phenoxy-ethyl)-2,5-dioxo-pyrrolidine-3-sulfonic acid CAS Name: 1-(2-hydroxy-1-oxo-1-phenoxypropan-2-yl)-2,5-dioxo-3-pyrrolidinesulfonic acid IUPAC Name: 1-(2-hydroxy-1-oxo-1-phenoxypropan-2-yl)-2,5-dioxopyrrolidine-3-sulfonic acid Traditional Name: 1-(1-hydroxy-2-keto-1-methyl-2-phenoxy-ethyl)-2,5-diketo-pyrrolidine-3-sulfonic acid Formula: C13H13NO8S MolecularWeight: 343.30922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=CC=C1)(N2C(=O)CC(C2=O)S(=O)(=O)O)O

Isomeric SMILES

CC(C(=O)OC1=CC=CC=C1)(N2C(=O)CC(C2=O)S(=O)(=O)O)O

InChI

InChI=1S/C13H13NO8S/c1-13(18,12(17)22-8-5-3-2-4-6-8)14-10(15)7-9(11(14)16)23(19,20)21/h2-6,9,18H,7H2,1H3,(H,19,20,21)