disodium (E)-2-methyl-5-phosphonato-pent-2-en-1-ol

Systemtic Name: disodium (E)-2-methyl-5-phosphonato-pent-2-en-1-ol Openeye Name: disodium (E)-2-methyl-5-phosphonato-pent-2-en-1-ol CAS Name: disodium (E)-2-methyl-5-phosphonato-2-penten-1-ol IUPAC Name: disodium (E)-2-methyl-5-phosphonatopent-2-en-1-ol Traditional Name: disodium (E)-2-methyl-5-phosphonato-pent-2-en-1-ol Formula: C6H11Na2O4P MolecularWeight: 224.102441

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCP(=O)([O-])[O-])CO.[Na+].[Na+]

Isomeric SMILES

C/C(=C\CCP(=O)([O-])[O-])/CO.[Na+].[Na+]

InChI

InChI=1S/C6H13O4P.2Na/c1-6(5-7)3-2-4-11(8,9)10;;/h3,7H,2,4-5H2,1H3,(H2,8,9,10);;/q;2*+1/p-2/b6-3+;;