2-methylidene-5-phosphono-hexanoate

Systemtic Name: 2-methylidene-5-phosphono-hexanoate Openeye Name: 2-methylene-5-phosphono-hexanoate CAS Name: 2-methylene-5-phosphonohexanoate IUPAC Name: 2-methylidene-5-phosphonohexanoate Traditional Name: 2-(3-phosphonobutyl)acrylate Formula: C7H12O5P- MolecularWeight: 207.140941

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=C)C(=O)[O-])P(=O)(O)O

Isomeric SMILES

CC(CCC(=C)C(=O)[O-])P(=O)(O)O

InChI

InChI=1S/C7H13O5P/c1-5(7(8)9)3-4-6(2)13(10,11)12/h6H,1,3-4H2,2H3,(H,8,9)(H2,10,11,12)/p-1