[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C11H13BrN2O3 MolecularWeight: 301.13652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=CC(=CN1)Br

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C1=CC(=CN1)Br

InChI

InChI=1S/C11H13BrN2O3/c1-3-4-13-10(15)7(2)17-11(16)9-5-8(12)6-14-9/h3,5-7,14H,1,4H2,2H3,(H,13,15)