N-[(4-aminocarbonylphenyl)methyl]-1-[2,4-bis(fluoranyl)phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-1-[2,4-bis(fluoranyl)phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-1-(2,4-difluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-1-[(2,4-difluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-1-(2,4-difluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-carbamoylbenzyl)-1-(2,4-difluorobenzoyl)isonipecotamide Formula: C21H21F2N3O3 MolecularWeight: 401.406546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)C(=O)N)C(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)C(=O)N)C(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C21H21F2N3O3/c22-16-5-6-17(18(23)11-16)21(29)26-9-7-15(8-10-26)20(28)25-12-13-1-3-14(4-2-13)19(24)27/h1-6,11,15H,7-10,12H2,(H2,24,27)(H,25,28)