2-[(4-chlorophenyl)methyl]-4-methyl-1H-pyrazol-3-one

Systemtic Name: 2-[(4-chlorophenyl)methyl]-4-methyl-1H-pyrazol-3-one Openeye Name: 2-[(4-chlorophenyl)methyl]-4-methyl-1H-pyrazol-3-one CAS Name: 2-[(4-chlorophenyl)methyl]-4-methyl-1H-pyrazol-3-one IUPAC Name: 2-[(4-chlorophenyl)methyl]-4-methyl-1H-pyrazol-3-one Traditional Name: 2-(4-chlorobenzyl)-4-methyl-3-pyrazolin-3-one Formula: C11H11ClN2O MolecularWeight: 222.67084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNN(C1=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CNN(C1=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H11ClN2O/c1-8-6-13-14(11(8)15)7-9-2-4-10(12)5-3-9/h2-6,13H,7H2,1H3