2-(4-chlorophenyl)-1-ethyl-4-phosphonato-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-1-ethyl-4-phosphonato-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-1-ethyl-4-phosphonato-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-1-ethyl-4-phosphonato-3-pyrazolone IUPAC Name: 2-(4-chlorophenyl)-1-ethyl-4-phosphonatopyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-1-ethyl-4-phosphonato-3-pyrazolin-3-one Formula: C11H10ClN2O4P-2 MolecularWeight: 300.634861

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N1C2=CC=C(C=C2)Cl)P(=O)([O-])[O-]

Isomeric SMILES

CCN1C=C(C(=O)N1C2=CC=C(C=C2)Cl)P(=O)([O-])[O-]

InChI

InChI=1S/C11H12ClN2O4P/c1-2-13-7-10(19(16,17)18)11(15)14(13)9-5-3-8(12)4-6-9/h3-7H,2H2,1H3,(H2,16,17,18)/p-2