4-methoxycarbonylhex-3-en-3-ylphosphonic acid

Systemtic Name: 4-methoxycarbonylhex-3-en-3-ylphosphonic acid Openeye Name: (1-ethyl-2-methoxycarbonyl-but-1-enyl)phosphonic acid CAS Name: 4-methoxycarbonylhex-3-en-3-ylphosphonic acid IUPAC Name: 4-methoxycarbonylhex-3-en-3-ylphosphonic acid Traditional Name: (2-carbomethoxy-1-ethyl-but-1-enyl)phosphonic acid Formula: C8H15O5P MolecularWeight: 222.175461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15O5P/c1-4-6(8(9)13-3)7(5-2)14(10,11)12/h4-5H2,1-3H3,(H2,10,11,12)