methyl 3-oxidanyl-5-oxidanylidene-6-phosphonato-hexanoate

Systemtic Name: methyl 3-oxidanyl-5-oxidanylidene-6-phosphonato-hexanoate Openeye Name: methyl 3-hydroxy-5-oxo-6-phosphonato-hexanoate CAS Name: 3-hydroxy-5-oxo-6-phosphonatohexanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-5-oxo-6-phosphonatohexanoate Traditional Name: 3-hydroxy-5-keto-6-phosphonato-hexanoic acid methyl ester Formula: C7H11O7P-2 MolecularWeight: 238.131801

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)CP(=O)([O-])[O-])O

Isomeric SMILES

COC(=O)CC(CC(=O)CP(=O)([O-])[O-])O

InChI

InChI=1S/C7H13O7P/c1-14-7(10)3-5(8)2-6(9)4-15(11,12)13/h5,8H,2-4H2,1H3,(H2,11,12,13)/p-2