[2-oxidanylidene-2-(propan-2-ylamino)ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)C1=CC(=CN1)C(=O)C

Isomeric SMILES

CC(C)NC(=O)COC(=O)C1=CC(=CN1)C(=O)C

InChI

InChI=1S/C12H16N2O4/c1-7(2)14-11(16)6-18-12(17)10-4-9(5-13-10)8(3)15/h4-5,7,13H,6H2,1-3H3,(H,14,16)