N-(1-adamantyl)-4-oxidanylidene-1-pentyl-6-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: N-(1-adamantyl)-4-oxidanylidene-1-pentyl-6-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: N-(1-adamantyl)-4-oxo-1-pentyl-6-(trifluoromethyl)quinoline-3-carboxamide CAS Name: N-(1-adamantyl)-4-oxo-1-pentyl-6-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-4-oxo-1-pentyl-6-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: N-(1-adamantyl)-1-amyl-4-keto-6-(trifluoromethyl)quinoline-3-carboxamide Formula: C26H31F3N2O2 MolecularWeight: 460.53175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31F3N2O2/c1-2-3-4-7-31-15-21(23(32)20-11-19(26(27,28)29)5-6-22(20)31)24(33)30-25-12-16-8-17(13-25)10-18(9-16)14-25/h5-6,11,15-18H,2-4,7-10,12-14H2,1H3,(H,30,33)