[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C12H17N3O3 MolecularWeight: 251.28168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C1=NC=CN=C1

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)C1=NC=CN=C1

InChI

InChI=1S/C12H17N3O3/c1-4-12(2,3)15-10(16)8-18-11(17)9-7-13-5-6-14-9/h5-7H,4,8H2,1-3H3,(H,15,16)