1-(cyanomethyl)-N-[1-(4-fluorophenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(cyanomethyl)-N-[1-(4-fluorophenyl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(cyanomethyl)-N-[2-(4-fluorophenyl)-1-(hydroxymethyl)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-(cyanomethyl)-N-[1-(4-fluorophenyl)-3-hydroxy-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(cyanomethyl)-N-[1-(4-fluorophenyl)-3-hydroxy-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(cyanomethyl)-N-[2-(4-fluorophenyl)-2-keto-1-methylol-ethyl]isonipecotamide Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CO)C(=O)C2=CC=C(C=C2)F)CC#N

Isomeric SMILES

C1CN(CCC1C(=O)NC(CO)C(=O)C2=CC=C(C=C2)F)CC#N

InChI

InChI=1S/C17H20FN3O3/c18-14-3-1-12(2-4-14)16(23)15(11-22)20-17(24)13-5-8-21(9-6-13)10-7-19/h1-4,13,15,22H,5-6,8-11H2,(H,20,24)