1-methyl-2-phosphono-pentane-1,2,4-tricarboxylic acid

Systemtic Name: 1-methyl-2-phosphono-pentane-1,2,4-tricarboxylic acid Openeye Name: 1-methyl-2-phosphono-pentane-1,2,4-tricarboxylic acid CAS Name: 1-methyl-2-phosphonopentane-1,2,4-tricarboxylic acid IUPAC Name: 1-methyl-2-phosphonopentane-1,2,4-tricarboxylic acid Traditional Name: 1-methyl-2-phosphono-pentane-1,2,4-tricarboxylic acid Formula: C9H15O9P MolecularWeight: 298.183761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15O9P/c1-4(6(10)11)3-9(8(14)15,19(16,17)18)5(2)7(12)13/h4-5H,3H2,1-2H3,(H,10,11)(H,12,13)(H,14,15)(H2,16,17,18)