[2-(tert-butylamino)-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C11H17N3O3 MolecularWeight: 239.27098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)C1=CN(N=C1)C

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)C1=CN(N=C1)C

InChI

InChI=1S/C11H17N3O3/c1-11(2,3)13-9(15)7-17-10(16)8-5-12-14(4)6-8/h5-6H,7H2,1-4H3,(H,13,15)