1-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-oxo-2-[1-(2-thienyl)ethylamino]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-keto-2-[1-(2-thienyl)ethylamino]ethyl]nipecotic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C14H20N2O3S/c1-10(12-5-3-7-20-12)15-13(17)9-16-6-2-4-11(8-16)14(18)19/h3,5,7,10-11H,2,4,6,8-9H2,1H3,(H,15,17)(H,18,19)