N-[[2,4-bis(fluoranyl)phenyl]methyl]-4-(4-phenylbut-3-enoylamino)piperidine-4-carboxamide

Systemtic Name: N-[[2,4-bis(fluoranyl)phenyl]methyl]-4-(4-phenylbut-3-enoylamino)piperidine-4-carboxamide Openeye Name: N-[(2,4-difluorophenyl)methyl]-4-(4-phenylbut-3-enoylamino)piperidine-4-carboxamide CAS Name: N-[(2,4-difluorophenyl)methyl]-4-[(1-oxo-4-phenylbut-3-enyl)amino]-4-piperidinecarboxamide IUPAC Name: N-[(2,4-difluorophenyl)methyl]-4-(4-phenylbut-3-enoylamino)piperidine-4-carboxamide Traditional Name: N-(2,4-difluorobenzyl)-4-(4-phenylbut-3-enoylamino)isonipecotamide Formula: C23H25F2N3O2 MolecularWeight: 413.460306

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)NCC2=C(C=C(C=C2)F)F)NC(=O)CC=CC3=CC=CC=C3

Isomeric SMILES

C1CNCCC1(C(=O)NCC2=C(C=C(C=C2)F)F)NC(=O)CC=CC3=CC=CC=C3

InChI

InChI=1S/C23H25F2N3O2/c24-19-10-9-18(20(25)15-19)16-27-22(30)23(11-13-26-14-12-23)28-21(29)8-4-7-17-5-2-1-3-6-17/h1-7,9-10,15,26H,8,11-14,16H2,(H,27,30)(H,28,29)