(3-methoxy-4-oxidanylidene-4-phenyl-1-phosphono-butyl)phosphonic acid

Systemtic Name: (3-methoxy-4-oxidanylidene-4-phenyl-1-phosphono-butyl)phosphonic acid Openeye Name: (3-methoxy-4-oxo-4-phenyl-1-phosphono-butyl)phosphonic acid CAS Name: (3-methoxy-4-oxo-4-phenyl-1-phosphonobutyl)phosphonic acid IUPAC Name: (3-methoxy-4-oxo-4-phenyl-1-phosphonobutyl)phosphonic acid Traditional Name: (4-keto-3-methoxy-4-phenyl-1-phosphono-butyl)phosphonic acid Formula: C11H16O8P2 MolecularWeight: 338.187462

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(P(=O)(O)O)P(=O)(O)O)C(=O)C1=CC=CC=C1

Isomeric SMILES

COC(CC(P(=O)(O)O)P(=O)(O)O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C11H16O8P2/c1-19-9(11(12)8-5-3-2-4-6-8)7-10(20(13,14)15)21(16,17)18/h2-6,9-10H,7H2,1H3,(H2,13,14,15)(H2,16,17,18)