[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C#CCNC(=O)COC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H19FN2O4/c1-2-9-20-16(22)12-25-18(24)14-4-3-10-21(11-14)17(23)13-5-7-15(19)8-6-13/h1,5-8,14H,3-4,9-12H2,(H,20,22)