2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Formula: C20H21F6NO MolecularWeight: 405.377259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21F6NO/c21-19(22,23)14-4-15(20(24,25)26)6-16(5-14)27-17(28)10-18-7-11-1-12(8-18)3-13(2-11)9-18/h4-6,11-13H,1-3,7-10H2,(H,27,28)