1-(2-thiophen-3-ylethanoyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(2-thiophen-3-ylethanoyl)piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-thienyl)acetyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-(3-thiophenyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxylic acid Traditional Name: 1-[2-(3-thienyl)acetyl]isonipecotic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CC2=CSC=C2

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CC2=CSC=C2

InChI

InChI=1S/C12H15NO3S/c14-11(7-9-3-6-17-8-9)13-4-1-10(2-5-13)12(15)16/h3,6,8,10H,1-2,4-5,7H2,(H,15,16)