(5-oxidanylidene-5-phenyl-2-phosphono-pentan-2-yl)phosphonic acid

Systemtic Name: (5-oxidanylidene-5-phenyl-2-phosphono-pentan-2-yl)phosphonic acid Openeye Name: (1-methyl-4-oxo-4-phenyl-1-phosphono-butyl)phosphonic acid CAS Name: (5-oxo-5-phenyl-2-phosphonopentan-2-yl)phosphonic acid IUPAC Name: (5-oxo-5-phenyl-2-phosphonopentan-2-yl)phosphonic acid Traditional Name: (4-keto-1-methyl-4-phenyl-1-phosphono-butyl)phosphonic acid Formula: C11H16O7P2 MolecularWeight: 322.188062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)C1=CC=CC=C1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CCC(=O)C1=CC=CC=C1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C11H16O7P2/c1-11(19(13,14)15,20(16,17)18)8-7-10(12)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,13,14,15)(H2,16,17,18)