4-[[(4-chlorophenyl)methylamino]methylidene]-3-methyl-1H-pyrazol-5-one

Systemtic Name: 4-[[(4-chlorophenyl)methylamino]methylidene]-3-methyl-1H-pyrazol-5-one Openeye Name: 4-[[(4-chlorophenyl)methylamino]methylene]-3-methyl-1H-pyrazol-5-one CAS Name: 4-[[(4-chlorophenyl)methylamino]methylidene]-3-methyl-1H-pyrazol-5-one IUPAC Name: 4-[[(4-chlorophenyl)methylamino]methylidene]-3-methyl-1H-pyrazol-5-one Traditional Name: 4-[[(4-chlorobenzyl)amino]methylene]-5-methyl-2-pyrazolin-3-one Formula: C12H12ClN3O MolecularWeight: 249.69618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C1=CNCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NNC(=O)C1=CNCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H12ClN3O/c1-8-11(12(17)16-15-8)7-14-6-9-2-4-10(13)5-3-9/h2-5,7,14H,6H2,1H3,(H,16,17)