2-(4-chlorophenyl)-5-methyl-4-propyl-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-5-methyl-4-propyl-1H-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-5-methyl-4-propyl-1H-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-5-methyl-4-propyl-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorophenyl)-5-methyl-4-propyl-1H-pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-5-methyl-4-propyl-3-pyrazolin-3-one Formula: C13H15ClN2O MolecularWeight: 250.724

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NN(C1=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCCC1=C(NN(C1=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C13H15ClN2O/c1-3-4-12-9(2)15-16(13(12)17)11-7-5-10(14)6-8-11/h5-8,15H,3-4H2,1-2H3