4-ethyl-3-methyl-3-(2-phosphonoethanoyl)hexanoate

Systemtic Name: 4-ethyl-3-methyl-3-(2-phosphonoethanoyl)hexanoate Openeye Name: 4-ethyl-3-methyl-3-(2-phosphonoacetyl)hexanoate CAS Name: 4-ethyl-3-methyl-3-(1-oxo-2-phosphonoethyl)hexanoate IUPAC Name: 4-ethyl-3-methyl-3-(2-phosphonoacetyl)hexanoate Traditional Name: 4-ethyl-3-methyl-3-(2-phosphonoacetyl)hexanoate Formula: C11H20O6P- MolecularWeight: 279.246661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C)(CC(=O)[O-])C(=O)CP(=O)(O)O

Isomeric SMILES

CCC(CC)C(C)(CC(=O)[O-])C(=O)CP(=O)(O)O

InChI

InChI=1S/C11H21O6P/c1-4-8(5-2)11(3,6-10(13)14)9(12)7-18(15,16)17/h8H,4-7H2,1-3H3,(H,13,14)(H2,15,16,17)/p-1