[3-(3,4-dichlorophenyl)-5-phosphono-4H-1,2-oxazol-5-yl]phosphonic acid

Systemtic Name: [3-(3,4-dichlorophenyl)-5-phosphono-4H-1,2-oxazol-5-yl]phosphonic acid Openeye Name: [3-(3,4-dichlorophenyl)-5-phosphono-4H-isoxazol-5-yl]phosphonic acid CAS Name: [3-(3,4-dichlorophenyl)-5-phosphono-4H-isoxazol-5-yl]phosphonic acid IUPAC Name: [3-(3,4-dichlorophenyl)-5-phosphono-4H-1,2-oxazol-5-yl]phosphonic acid Traditional Name: [3-(3,4-dichlorophenyl)-5-phosphono-2-isoxazolin-5-yl]phosphonic acid Formula: C9H9Cl2NO7P2 MolecularWeight: 376.023782

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NOC1(P(=O)(O)O)P(=O)(O)O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1C(=NOC1(P(=O)(O)O)P(=O)(O)O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C9H9Cl2NO7P2/c10-6-2-1-5(3-7(6)11)8-4-9(19-12-8,20(13,14)15)21(16,17)18/h1-3H,4H2,(H2,13,14,15)(H2,16,17,18)