ethyl 5-(2,2-dimethylpropoxy)-1-(2-ethoxy-2-oxidanylidene-ethyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2,2-dimethylpropoxy)-1-(2-ethoxy-2-oxidanylidene-ethyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-(2,2-dimethylpropoxy)-1-(2-ethoxy-2-oxo-ethyl)pyrazole-3-carboxylate CAS Name: 5-(2,2-dimethylpropoxy)-1-(2-ethoxy-2-oxoethyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dimethylpropoxy)-1-(2-ethoxy-2-oxoethyl)pyrazole-3-carboxylate Traditional Name: 1-(2-ethoxy-2-keto-ethyl)-5-neopentyloxy-pyrazole-3-carboxylic acid ethyl ester Formula: C15H24N2O5 MolecularWeight: 312.36146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=CC(=N1)C(=O)OCC)OCC(C)(C)C

Isomeric SMILES

CCOC(=O)CN1C(=CC(=N1)C(=O)OCC)OCC(C)(C)C

InChI

InChI=1S/C15H24N2O5/c1-6-20-13(18)9-17-12(22-10-15(3,4)5)8-11(16-17)14(19)21-7-2/h8H,6-7,9-10H2,1-5H3