2-phosphono-2-prop-2-ynyl-butanedioic acid

Systemtic Name: 2-phosphono-2-prop-2-ynyl-butanedioic acid Openeye Name: 2-phosphono-2-prop-2-ynyl-butanedioic acid CAS Name: 2-phosphono-2-prop-2-ynylbutanedioic acid IUPAC Name: 2-phosphono-2-prop-2-ynylbutanedioic acid Traditional Name: 2-phosphono-2-propargyl-succinic acid Formula: C7H9O7P MolecularWeight: 236.115921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9O7P/c1-2-3-7(6(10)11,4-5(8)9)15(12,13)14/h1H,3-4H2,(H,8,9)(H,10,11)(H2,12,13,14)