N-ethyl-1-(4-fluorophenyl)carbonyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide

Systemtic Name: N-ethyl-1-(4-fluorophenyl)carbonyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide Openeye Name: N-ethyl-1-(4-fluorobenzoyl)-N-[2-(isopropylamino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: N-ethyl-1-[(4-fluorophenyl)-oxomethyl]-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: N-ethyl-1-(4-fluorobenzoyl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide Traditional Name: N-ethyl-1-(4-fluorobenzoyl)-N-[2-(isopropylamino)-2-keto-ethyl]nipecotamide Formula: C20H28FN3O3 MolecularWeight: 377.453023

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H28FN3O3/c1-4-23(13-18(25)22-14(2)3)20(27)16-6-5-11-24(12-16)19(26)15-7-9-17(21)10-8-15/h7-10,14,16H,4-6,11-13H2,1-3H3,(H,22,25)