3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C26H26BrF3N2O2 MolecularWeight: 535.39605

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC=CC(=C4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC=CC(=C4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C26H26BrF3N2O2/c27-25-12-16-7-17(13-25)11-24(10-16,15-25)14-22(33)31-20-5-1-3-18(8-20)23(34)32-21-6-2-4-19(9-21)26(28,29)30/h1-6,8-9,16-17H,7,10-15H2,(H,31,33)(H,32,34)