sodium [4-(3-chloranylpropanoyloxy)-5-(oxidanidyloxymethyl)pyridin-2-yl] 3-chloranyl-2-oxidanyl-propanoate

Systemtic Name: sodium [4-(3-chloranylpropanoyloxy)-5-(oxidanidyloxymethyl)pyridin-2-yl] 3-chloranyl-2-oxidanyl-propanoate Openeye Name: sodium [4-(3-chloropropanoyloxy)-5-(oxidooxymethyl)-2-pyridyl] 3-chloro-2-hydroxy-propanoate CAS Name: sodium 3-chloro-2-hydroxypropanoic acid [4-(3-chloro-1-oxopropoxy)-5-(oxidooxymethyl)-2-pyridinyl] ester IUPAC Name: sodium [4-(3-chloropropanoyloxy)-5-(oxidooxymethyl)pyridin-2-yl] 3-chloro-2-hydroxypropanoate Traditional Name: sodium 3-chloro-2-hydroxy-propionic acid [4-(3-chloropropanoyloxy)-5-(oxidooxymethyl)-2-pyridyl] ester Formula: C12H12Cl2NNaO7 MolecularWeight: 376.12195

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CN=C1OC(=O)C(CCl)O)CO[O-])OC(=O)CCCl.[Na+]

Isomeric SMILES

C1=C(C(=CN=C1OC(=O)C(CCl)O)CO[O-])OC(=O)CCCl.[Na+]

InChI

InChI=1S/C12H13Cl2NO7.Na/c13-2-1-11(17)21-9-3-10(15-5-7(9)6-20-19)22-12(18)8(16)4-14;/h3,5,8,16,19H,1-2,4,6H2;/q;+1/p-1