(E)-3-ethyl-2-phosphono-hex-2-enoic acid

Systemtic Name: (E)-3-ethyl-2-phosphono-hex-2-enoic acid Openeye Name: (E)-3-ethyl-2-phosphono-hex-2-enoic acid CAS Name: (E)-3-ethyl-2-phosphono-2-hexenoic acid IUPAC Name: (E)-3-ethyl-2-phosphonohex-2-enoic acid Traditional Name: (E)-3-ethyl-2-phosphono-hex-2-enoic acid Formula: C8H15O5P MolecularWeight: 222.175461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC/C(=C(\C(=O)O)/P(=O)(O)O)/CC

InChI

InChI=1S/C8H15O5P/c1-3-5-6(4-2)7(8(9)10)14(11,12)13/h3-5H2,1-2H3,(H,9,10)(H2,11,12,13)/b7-6+