N-[4-[bis(fluoranyl)methylsulfonyl]-2-(phenylcarbonyl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfonyl]-2-(phenylcarbonyl)phenyl]adamantane-1-carboxamide Openeye Name: N-[2-benzoyl-4-(difluoromethylsulfonyl)phenyl]adamantane-1-carboxamide CAS Name: N-[2-benzoyl-4-(difluoromethylsulfonyl)phenyl]-1-adamantanecarboxamide IUPAC Name: N-[2-benzoyl-4-(difluoromethylsulfonyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[2-benzoyl-4-(difluoromethylsulfonyl)phenyl]adamantane-1-carboxamide Formula: C25H25F2NO4S MolecularWeight: 473.532106

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)S(=O)(=O)C(F)F)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)S(=O)(=O)C(F)F)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H25F2NO4S/c26-24(27)33(31,32)19-6-7-21(20(11-19)22(29)18-4-2-1-3-5-18)28-23(30)25-12-15-8-16(13-25)10-17(9-15)14-25/h1-7,11,15-17,24H,8-10,12-14H2,(H,28,30)