butanoate; [(Z)-3-ethoxycarbonyl-2-ethyl-pent-2-enyl]phosphonic acid

Systemtic Name: butanoate; [(Z)-3-ethoxycarbonyl-2-ethyl-pent-2-enyl]phosphonic acid Openeye Name: butanoate; [(Z)-3-ethoxycarbonyl-2-ethyl-pent-2-enyl]phosphonic acid CAS Name: butanoate; [(Z)-3-ethoxycarbonyl-2-ethylpent-2-enyl]phosphonic acid IUPAC Name: butanoate; [(Z)-3-ethoxycarbonyl-2-ethylpent-2-enyl]phosphonic acid Traditional Name: butyrate; [(Z)-3-carbethoxy-2-ethyl-pent-2-enyl]phosphonic acid Formula: C14H26O7P- MolecularWeight: 337.325801

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].CCC(=C(CC)C(=O)OCC)CP(=O)(O)O

Isomeric SMILES

CCCC(=O)[O-].CC/C(=C(\CC)/C(=O)OCC)/CP(=O)(O)O

InChI

InChI=1S/C10H19O5P.C4H8O2/c1-4-8(7-16(12,13)14)9(5-2)10(11)15-6-3;1-2-3-4(5)6/h4-7H2,1-3H3,(H2,12,13,14);2-3H2,1H3,(H,5,6)/p-1/b9-8-;