2-[1-(3-chloranyl-4-methyl-phenyl)ethyl]-4,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 2-[1-(3-chloranyl-4-methyl-phenyl)ethyl]-4,5-dimethyl-1H-pyrazol-3-one Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)ethyl]-4,5-dimethyl-1H-pyrazol-3-one CAS Name: 2-[1-(3-chloro-4-methylphenyl)ethyl]-4,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)ethyl]-4,5-dimethyl-1H-pyrazol-3-one Traditional Name: 2-[1-(3-chloro-4-methyl-phenyl)ethyl]-4,5-dimethyl-3-pyrazolin-3-one Formula: C14H17ClN2O MolecularWeight: 264.75058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)N2C(=O)C(=C(N2)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)N2C(=O)C(=C(N2)C)C)Cl

InChI

InChI=1S/C14H17ClN2O/c1-8-5-6-12(7-13(8)15)11(4)17-14(18)9(2)10(3)16-17/h5-7,11,16H,1-4H3