1-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]nipecotic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NC2=C(C=CS2)C#N)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC(=O)NC2=C(C=CS2)C#N)C(=O)O

InChI

InChI=1S/C13H15N3O3S/c14-6-9-3-5-20-12(9)15-11(17)8-16-4-1-2-10(7-16)13(18)19/h3,5,10H,1-2,4,7-8H2,(H,15,17)(H,18,19)