1-phosphonobutane-1,2,2-tricarboxylic acid

Systemtic Name: 1-phosphonobutane-1,2,2-tricarboxylic acid Openeye Name: 1-phosphonobutane-1,2,2-tricarboxylic acid CAS Name: 1-phosphonobutane-1,2,2-tricarboxylic acid IUPAC Name: 1-phosphonobutane-1,2,2-tricarboxylic acid Traditional Name: 1-phosphonobutane-1,2,2-tricarboxylic acid Formula: C7H11O9P MolecularWeight: 270.130601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11O9P/c1-2-7(5(10)11,6(12)13)3(4(8)9)17(14,15)16/h3H,2H2,1H3,(H,8,9)(H,10,11)(H,12,13)(H2,14,15,16)