[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C12H16N2O3 MolecularWeight: 236.26704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C1=CC=NC=C1

Isomeric SMILES

CC(C)CNC(=O)COC(=O)C1=CC=NC=C1

InChI

InChI=1S/C12H16N2O3/c1-9(2)7-14-11(15)8-17-12(16)10-3-5-13-6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15)