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

Systemtic Name: [2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(2-methyl-1-piperidyl)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(2-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpiperidin-1-yl)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-keto-2-(2-methylpiperidino)ethyl] ester Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CC1CCCCN1C(=O)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H17BrN2O3/c1-9-4-2-3-5-16(9)12(17)8-19-13(18)11-6-10(14)7-15-11/h6-7,9,15H,2-5,8H2,1H3