4-(1-adamantyl)-N-(3-chloranyl-4-fluoranyl-phenyl)benzenesulfonamide

Systemtic Name: 4-(1-adamantyl)-N-(3-chloranyl-4-fluoranyl-phenyl)benzenesulfonamide Openeye Name: 4-(1-adamantyl)-N-(3-chloro-4-fluoro-phenyl)benzenesulfonamide CAS Name: 4-(1-adamantyl)-N-(3-chloro-4-fluorophenyl)benzenesulfonamide IUPAC Name: 4-(1-adamantyl)-N-(3-chloro-4-fluorophenyl)benzenesulfonamide Traditional Name: 4-(1-adamantyl)-N-(3-chloro-4-fluoro-phenyl)benzenesulfonamide Formula: C22H23ClFNO2S MolecularWeight: 419.939923

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)S(=O)(=O)NC5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)S(=O)(=O)NC5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C22H23ClFNO2S/c23-20-10-18(3-6-21(20)24)25-28(26,27)19-4-1-17(2-5-19)22-11-14-7-15(12-22)9-16(8-14)13-22/h1-6,10,14-16,25H,7-9,11-13H2