2-oxidanylidenepropyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 2-oxidanylidenepropyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: acetonyl 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 5-chloro-3-methyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylic acid acetonyl ester Formula: C14H13ClN2O3 MolecularWeight: 292.71762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)C)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)C)Cl)C2=CC=CC=C2

InChI

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