[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(diisopropylamino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[di(propan-2-yl)amino]-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(diisopropylamino)-2-keto-ethyl] ester Formula: C13H19BrN2O3 MolecularWeight: 331.20556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrN2O3/c1-8(2)16(9(3)4)12(17)7-19-13(18)11-5-10(14)6-15-11/h5-6,8-9,15H,7H2,1-4H3