1-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-oxo-2-(2-thienylmethylamino)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-keto-2-(2-thenylamino)ethyl]isonipecotic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC(=O)NCC2=CC=CS2

Isomeric SMILES

C1CN(CCC1C(=O)O)CC(=O)NCC2=CC=CS2

InChI

InChI=1S/C13H18N2O3S/c16-12(14-8-11-2-1-7-19-11)9-15-5-3-10(4-6-15)13(17)18/h1-2,7,10H,3-6,8-9H2,(H,14,16)(H,17,18)