[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C11H15BrN2O3 MolecularWeight: 303.1524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C1=CC(=CN1)Br

Isomeric SMILES

CC(C)CNC(=O)COC(=O)C1=CC(=CN1)Br

InChI

InChI=1S/C11H15BrN2O3/c1-7(2)4-14-10(15)6-17-11(16)9-3-8(12)5-13-9/h3,5,7,13H,4,6H2,1-2H3,(H,14,15)