tert-butyl 4-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H28N4O3 MolecularWeight: 336.42922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1C)C)CC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H28N4O3/c1-12-14(13(2)19(6)18-12)11-15(22)20-7-9-21(10-8-20)16(23)24-17(3,4)5/h7-11H2,1-6H3