1-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]nipecotic acid Formula: C15H24N2O3 MolecularWeight: 280.36266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCCC(C1)C(=O)O

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCCC(C1)C(=O)O

InChI

InChI=1S/C15H24N2O3/c1-4-15(5-2,6-3)16-13(18)11-17-9-7-8-12(10-17)14(19)20/h1,12H,5-11H2,2-3H3,(H,16,18)(H,19,20)