1-(2-benzamidoethanoyl)-N-(3-chloranyl-4-fluoranyl-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(2-benzamidoethanoyl)-N-(3-chloranyl-4-fluoranyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-(2-benzamidoacetyl)-N-(3-chloro-4-fluoro-phenyl)piperidine-3-carboxamide CAS Name: 1-(2-benzamido-1-oxoethyl)-N-(3-chloro-4-fluorophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(2-benzamidoacetyl)-N-(3-chloro-4-fluorophenyl)piperidine-3-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-hippuroyl-nipecotamide Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CNC(=O)C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)CNC(=O)C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O3/c22-17-11-16(8-9-18(17)23)25-21(29)15-7-4-10-26(13-15)19(27)12-24-20(28)14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,24,28)(H,25,29)