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2,2,4,4-tetraethyl-3,3-diphosphono-heptanedioic acid

2,2,4,4-tetraethyl-3,3-diphosphono-heptanedioic acid

Systemtic Name:2,2,4,4-tetraethyl-3,3-diphosphono-heptanedioic acid
Openeye Name:2,2,4,4-tetraethyl-3,3-diphosphono-heptanedioic acid
CAS Name:2,2,4,4-tetraethyl-3,3-diphosphonoheptanedioic acid
IUPAC Name:2,2,4,4-tetraethyl-3,3-diphosphonoheptanedioic acid
Traditional Name:2,2,4,4-tetraethyl-3,3-diphosphono-pimelic acid
Formula: C15H30O10P2
MolecularWeight: 432.340222
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H30O10P2/c1-5-13(6-2,10-9-11(16)17)15(26(20,21)22,27(23,24)25)14(7-3,8-4)12(18)19/h5-10H2,1-4H3,(H,16,17)(H,18,19)(H2,20,21,22)(H2,23,24,25)


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