ethyl 2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylate; sodium

Systemtic Name: ethyl 2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylate; sodium Openeye Name: ethyl 2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]thiazolidine-4-carboxylate; sodium CAS Name: 2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]-4-thiazolidinecarboxylic acid ethyl ester; sodium IUPAC Name: ethyl 2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylate; sodium Traditional Name: 2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]thiazolidine-4-carboxylic acid ethyl ester; sodium Formula: C13H19N2NaO7PS MolecularWeight: 401.327691

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(N1)C2=C(C(=NC=C2COP(=O)(O)O)C)O.[Na]

Isomeric SMILES

CCOC(=O)C1CSC(N1)C2=C(C(=NC=C2COP(=O)(O)O)C)O.[Na]

InChI

InChI=1S/C13H19N2O7PS.Na/c1-3-21-13(17)9-6-24-12(15-9)10-8(5-22-23(18,19)20)4-14-7(2)11(10)16;/h4,9,12,15-16H,3,5-6H2,1-2H3,(H2,18,19,20);