ethyl 1-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(4-bromo-1H-pyrrole-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromo-1H-pyrrole-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(4-bromo-1H-pyrrole-2-carbonyl)isonipecotic acid ethyl ester Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CN2)Br

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H17BrN2O3/c1-2-19-13(18)9-3-5-16(6-4-9)12(17)11-7-10(14)8-15-11/h7-9,15H,2-6H2,1H3