ethyl 2-(4-chloranyl-2-methyl-phenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 2-(4-chloranyl-2-methyl-phenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylate Openeye Name: ethyl 2-(4-chloro-2-methyl-phenyl)-3-oxo-1H-pyrazole-5-carboxylate CAS Name: 2-(4-chloro-2-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-2-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylate Traditional Name: 1-(4-chloro-2-methyl-phenyl)-5-keto-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)N(N1)C2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=CC(=O)N(N1)C2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C13H13ClN2O3/c1-3-19-13(18)10-7-12(17)16(15-10)11-5-4-9(14)6-8(11)2/h4-7,15H,3H2,1-2H3