4-phenyl-2,4-diphosphono-butanoic acid

Systemtic Name: 4-phenyl-2,4-diphosphono-butanoic acid Openeye Name: 4-phenyl-2,4-diphosphono-butanoic acid CAS Name: 4-phenyl-2,4-diphosphonobutanoic acid IUPAC Name: 4-phenyl-2,4-diphosphonobutanoic acid Traditional Name: 4-phenyl-2,4-diphosphono-butyric acid Formula: C10H14O8P2 MolecularWeight: 324.160882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O8P2/c11-10(12)9(20(16,17)18)6-8(19(13,14)15)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12)(H2,13,14,15)(H2,16,17,18)