6-(1-adamantyl)-N-[2-chloranyl-4-(trifluoromethylsulfonyl)phenyl]-5-oxidanyl-2,3-dihydro-1H-indene-4-carboxamide

Systemtic Name: 6-(1-adamantyl)-N-[2-chloranyl-4-(trifluoromethylsulfonyl)phenyl]-5-oxidanyl-2,3-dihydro-1H-indene-4-carboxamide Openeye Name: 6-(1-adamantyl)-N-[2-chloro-4-(trifluoromethylsulfonyl)phenyl]-5-hydroxy-indane-4-carboxamide CAS Name: 6-(1-adamantyl)-N-[2-chloro-4-(trifluoromethylsulfonyl)phenyl]-5-hydroxy-2,3-dihydro-1H-indene-4-carboxamide IUPAC Name: 6-(1-adamantyl)-N-[2-chloro-4-(trifluoromethylsulfonyl)phenyl]-5-hydroxy-2,3-dihydro-1H-indene-4-carboxamide Traditional Name: 6-(1-adamantyl)-N-(2-chloro-4-triflyl-phenyl)-5-hydroxy-indane-4-carboxamide Formula: C27H27ClF3NO4S MolecularWeight: 554.02079

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=C(C(=C2C1)C(=O)NC3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)Cl)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC2=CC(=C(C(=C2C1)C(=O)NC3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)Cl)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H27ClF3NO4S/c28-21-10-18(37(35,36)27(29,30)31)4-5-22(21)32-25(34)23-19-3-1-2-17(19)9-20(24(23)33)26-11-14-6-15(12-26)8-16(7-14)13-26/h4-5,9-10,14-16,33H,1-3,6-8,11-13H2,(H,32,34)