2-oxidanylidenepropyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: 2-oxidanylidenepropyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: acetonyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid acetonyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC(=NN1C2=CC=CC=C2)C3CC3

Isomeric SMILES

CC(=O)COC(=O)C1=CC(=NN1C2=CC=CC=C2)C3CC3

InChI

InChI=1S/C16H16N2O3/c1-11(19)10-21-16(20)15-9-14(12-7-8-12)17-18(15)13-5-3-2-4-6-13/h2-6,9,12H,7-8,10H2,1H3