ethyl (E)-3-methyl-4-phosphonato-but-2-enoate

Systemtic Name: ethyl (E)-3-methyl-4-phosphonato-but-2-enoate Openeye Name: ethyl (E)-3-methyl-4-phosphonato-but-2-enoate CAS Name: (E)-3-methyl-4-phosphonato-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-methyl-4-phosphonatobut-2-enoate Traditional Name: (E)-3-methyl-4-phosphonato-but-2-enoic acid ethyl ester Formula: C7H11O5P-2 MolecularWeight: 206.133001

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)CP(=O)([O-])[O-]

Isomeric SMILES

CCOC(=O)/C=C(\C)/CP(=O)([O-])[O-]

InChI

InChI=1S/C7H13O5P/c1-3-12-7(8)4-6(2)5-13(9,10)11/h4H,3,5H2,1-2H3,(H2,9,10,11)/p-2/b6-4+