1-[1-(5-bromanylthiophen-2-yl)propyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(5-bromanylthiophen-2-yl)propyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(5-bromo-2-thienyl)propyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(5-bromo-2-thiophenyl)propyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(5-bromothiophen-2-yl)propyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(5-bromo-2-thienyl)propyl]isonipecotic acid Formula: C13H18BrNO2S MolecularWeight: 332.25652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(S1)Br)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(S1)Br)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H18BrNO2S/c1-2-10(11-3-4-12(14)18-11)15-7-5-9(6-8-15)13(16)17/h3-4,9-10H,2,5-8H2,1H3,(H,16,17)