(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 1H-pyrazole-5-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 1H-pyrazole-5-carboxylate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=NN2

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=NN2

InChI

InChI=1S/C13H12N2O4/c1-18-13(17)11(9-5-3-2-4-6-9)19-12(16)10-7-8-14-15-10/h2-8,11H,1H3,(H,14,15)