ethyl 1-[(4-bromanylthiophen-2-yl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-bromanylthiophen-2-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(4-bromo-2-thienyl)methyl]piperidine-3-carboxylate CAS Name: 1-[(4-bromo-2-thiophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-bromothiophen-2-yl)methyl]piperidine-3-carboxylate Traditional Name: 1-[(4-bromo-2-thienyl)methyl]nipecotic acid ethyl ester Formula: C13H18BrNO2S MolecularWeight: 332.25652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=CC(=CS2)Br

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=CC(=CS2)Br

InChI

InChI=1S/C13H18BrNO2S/c1-2-17-13(16)10-4-3-5-15(7-10)8-12-6-11(14)9-18-12/h6,9-10H,2-5,7-8H2,1H3