2-butyl-2,4-diphosphono-pentanedioic acid

Systemtic Name: 2-butyl-2,4-diphosphono-pentanedioic acid Openeye Name: 2-butyl-2,4-diphosphono-pentanedioic acid CAS Name: 2-butyl-2,4-diphosphonopentanedioic acid IUPAC Name: 2-butyl-2,4-diphosphonopentanedioic acid Traditional Name: 2-butyl-2,4-diphosphono-glutaric acid Formula: C9H18O10P2 MolecularWeight: 348.180742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

CCCCC(CC(C(=O)O)P(=O)(O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C9H18O10P2/c1-2-3-4-9(8(12)13,21(17,18)19)5-6(7(10)11)20(14,15)16/h6H,2-5H2,1H3,(H,10,11)(H,12,13)(H2,14,15,16)(H2,17,18,19)