1-[2-(4-chlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]butane-1,3-dione

Systemtic Name: 1-[2-(4-chlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]butane-1,3-dione Openeye Name: 1-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione CAS Name: 1-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione IUPAC Name: 1-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione Traditional Name: 1-[1-(4-chlorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]butane-1,3-dione Formula: C14H13ClN2O3 MolecularWeight: 292.71762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C(=O)CC(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C(=O)CC(=O)C

InChI

InChI=1S/C14H13ClN2O3/c1-8(18)7-12(19)13-9(2)16-17(14(13)20)11-5-3-10(15)4-6-11/h3-6,16H,7H2,1-2H3