1-[2,4-bis(fluoranyl)phenyl]carbonyl-N-(3-iodanyl-4-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]carbonyl-N-(3-iodanyl-4-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(2,4-difluorobenzoyl)-N-(3-iodo-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[(2,4-difluorophenyl)-oxomethyl]-N-(3-iodo-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,4-difluorobenzoyl)-N-(3-iodo-4-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2,4-difluorobenzoyl)-N-(3-iodo-4-methyl-phenyl)isonipecotamide Formula: C20H19F2IN2O2 MolecularWeight: 484.278336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)F)F)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)F)F)I

InChI

InChI=1S/C20H19F2IN2O2/c1-12-2-4-15(11-18(12)23)24-19(26)13-6-8-25(9-7-13)20(27)16-5-3-14(21)10-17(16)22/h2-5,10-11,13H,6-9H2,1H3,(H,24,26)