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

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)methyl]-4,5-dimethyl-1H-pyrazol-3-one Openeye Name: 2-[(3-chloro-4-methyl-phenyl)methyl]-4,5-dimethyl-1H-pyrazol-3-one CAS Name: 2-[(3-chloro-4-methylphenyl)methyl]-4,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 2-[(3-chloro-4-methylphenyl)methyl]-4,5-dimethyl-1H-pyrazol-3-one Traditional Name: 2-(3-chloro-4-methyl-benzyl)-4,5-dimethyl-3-pyrazolin-3-one Formula: C13H15ClN2O MolecularWeight: 250.724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2C(=O)C(=C(N2)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CN2C(=O)C(=C(N2)C)C)Cl

InChI

InChI=1S/C13H15ClN2O/c1-8-4-5-11(6-12(8)14)7-16-13(17)9(2)10(3)15-16/h4-6,15H,7H2,1-3H3