N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide CAS Name: N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-(1-adamantylmethyl)-3,5-bis(trifluoromethyl)benzamide Formula: C20H21F6NO MolecularWeight: 405.377259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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