sodium 2-[2,4-bis(chloranyl)-6-phenylmethoxy-phenyl]ethyl-(4-methoxy-2-oxidanyl-4-oxidanylidene-butyl)phosphinate

Systemtic Name: sodium 2-[2,4-bis(chloranyl)-6-phenylmethoxy-phenyl]ethyl-(4-methoxy-2-oxidanyl-4-oxidanylidene-butyl)phosphinate Openeye Name: sodium 2-(2-benzyloxy-4,6-dichloro-phenyl)ethyl-(2-hydroxy-4-methoxy-4-oxo-butyl)phosphinate CAS Name: sodium 2-(2,4-dichloro-6-phenylmethoxyphenyl)ethyl-(2-hydroxy-4-methoxy-4-oxobutyl)phosphinate IUPAC Name: sodium 2-(2,4-dichloro-6-phenylmethoxyphenyl)ethyl-(2-hydroxy-4-methoxy-4-oxobutyl)phosphinate Traditional Name: sodium 2-(2-benzoxy-4,6-dichloro-phenyl)ethyl-(2-hydroxy-4-keto-4-methoxy-butyl)phosphinate Formula: C20H22Cl2NaO6P MolecularWeight: 483.254611

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CP(=O)(CCC1=C(C=C(C=C1OCC2=CC=CC=C2)Cl)Cl)[O-])O.[Na+]

Isomeric SMILES

COC(=O)CC(CP(=O)(CCC1=C(C=C(C=C1OCC2=CC=CC=C2)Cl)Cl)[O-])O.[Na+]

InChI

InChI=1S/C20H23Cl2O6P.Na/c1-27-20(24)11-16(23)13-29(25,26)8-7-17-18(22)9-15(21)10-19(17)28-12-14-5-3-2-4-6-14;/h2-6,9-10,16,23H,7-8,11-13H2,1H3,(H,25,26);/q;+1/p-1