(3-methoxy-4-oxidanylidene-heptan-3-yl)phosphonic acid

Systemtic Name: (3-methoxy-4-oxidanylidene-heptan-3-yl)phosphonic acid Openeye Name: (1-ethyl-1-methoxy-2-oxo-pentyl)phosphonic acid CAS Name: (3-methoxy-4-oxoheptan-3-yl)phosphonic acid IUPAC Name: (3-methoxy-4-oxoheptan-3-yl)phosphonic acid Traditional Name: (1-ethyl-2-keto-1-methoxy-pentyl)phosphonic acid Formula: C8H17O5P MolecularWeight: 224.191341

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC)(OC)P(=O)(O)O

Isomeric SMILES

CCCC(=O)C(CC)(OC)P(=O)(O)O

InChI

InChI=1S/C8H17O5P/c1-4-6-7(9)8(5-2,13-3)14(10,11)12/h4-6H2,1-3H3,(H2,10,11,12)