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

Systemtic Name: 1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-[(3-cyano-2-thienyl)amino]-3-oxo-propyl]piperidine-3-carboxylic acid CAS Name: 1-[3-[(3-cyano-2-thiophenyl)amino]-3-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxopropyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-[(3-cyano-2-thienyl)amino]-3-keto-propyl]nipecotic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3S/c15-8-10-4-7-21-13(10)16-12(18)3-6-17-5-1-2-11(9-17)14(19)20/h4,7,11H,1-3,5-6,9H2,(H,16,18)(H,19,20)