1-(5-bromanylthiophen-3-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(5-bromanylthiophen-3-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(5-bromothiophene-3-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(5-bromo-3-thiophenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-bromothiophene-3-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(5-bromothiophene-3-carbonyl)isonipecotic acid Formula: C11H12BrNO3S MolecularWeight: 318.18688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CSC(=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C11H12BrNO3S/c12-9-5-8(6-17-9)10(14)13-3-1-7(2-4-13)11(15)16/h5-7H,1-4H2,(H,15,16)