diethyl 2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]propanedioate

Systemtic Name: diethyl 2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]propanedioate Openeye Name: diethyl 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]propanedioate CAS Name: 2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]propanedioate Traditional Name: 2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]malonic acid diethyl ester Formula: C13H17BrN2O5 MolecularWeight: 361.18848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)C1=CC(=CN1C)Br

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)C1=CC(=CN1C)Br

InChI

InChI=1S/C13H17BrN2O5/c1-4-20-12(18)10(13(19)21-5-2)15-11(17)9-6-8(14)7-16(9)3/h6-7,10H,4-5H2,1-3H3,(H,15,17)