N-(2-adamantyl)-4-[bis(fluoranyl)methylsulfonyl]benzamide

Systemtic Name: N-(2-adamantyl)-4-[bis(fluoranyl)methylsulfonyl]benzamide Openeye Name: N-(2-adamantyl)-4-(difluoromethylsulfonyl)benzamide CAS Name: N-(2-adamantyl)-4-(difluoromethylsulfonyl)benzamide IUPAC Name: N-(2-adamantyl)-4-(difluoromethylsulfonyl)benzamide Traditional Name: N-(2-adamantyl)-4-(difluoromethylsulfonyl)benzamide Formula: C18H21F2NO3S MolecularWeight: 369.426046

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=C(C=C4)S(=O)(=O)C(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=C(C=C4)S(=O)(=O)C(F)F

InChI

InChI=1S/C18H21F2NO3S/c19-18(20)25(23,24)15-3-1-12(2-4-15)17(22)21-16-13-6-10-5-11(8-13)9-14(16)7-10/h1-4,10-11,13-14,16,18H,5-9H2,(H,21,22)