2-(6-chloranylpyridin-2-yl)-5-methyl-4-(phenylmethyl)-1H-pyrazol-3-one

Systemtic Name: 2-(6-chloranylpyridin-2-yl)-5-methyl-4-(phenylmethyl)-1H-pyrazol-3-one Openeye Name: 4-benzyl-2-(6-chloro-2-pyridyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-(6-chloro-2-pyridinyl)-5-methyl-4-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 4-benzyl-2-(6-chloropyridin-2-yl)-5-methyl-1H-pyrazol-3-one Traditional Name: 4-benzyl-2-(6-chloro-2-pyridyl)-5-methyl-3-pyrazolin-3-one Formula: C16H14ClN3O MolecularWeight: 299.75486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC(=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C16H14ClN3O/c1-11-13(10-12-6-3-2-4-7-12)16(21)20(19-11)15-9-5-8-14(17)18-15/h2-9,19H,10H2,1H3