2-(3-chloranyl-4-methyl-phenyl)-5-propyl-4H-pyrazol-3-one

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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