5-(3-chloranylpropyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-(3-chloranylpropyl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-(3-chloropropyl)-2-phenyl-4H-pyrazol-3-one CAS Name: 5-(3-chloropropyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-(3-chloropropyl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-(3-chloropropyl)-2-phenyl-2-pyrazolin-3-one Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)CCCCl

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)CCCCl

InChI

InChI=1S/C12H13ClN2O/c13-8-4-5-10-9-12(16)15(14-10)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-9H2