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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15BrN2O3/c1-3-7(2)14-10(15)6-17-11(16)9-4-8(12)5-13-9/h4-5,7,13H,3,6H2,1-2H3,(H,14,15)