2-[4-methyl-2-oxidanyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile

Systemtic Name: 2-[4-methyl-2-oxidanyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile Openeye Name: 2-[2-hydroxy-4-methyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile CAS Name: 2-[2-hydroxy-4-methyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile IUPAC Name: 2-[2-hydroxy-4-methyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile Traditional Name: 2-[2-hydroxy-4-methyl-4-phenyl-2-(trifluoromethyl)pentyl]-1H-indole-3-carbonitrile Formula: C22H21F3N2O MolecularWeight: 386.41015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=C(C2=CC=CC=C2N1)C#N)(C(F)(F)F)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(CC(CC1=C(C2=CC=CC=C2N1)C#N)(C(F)(F)F)O)C3=CC=CC=C3

InChI

InChI=1S/C22H21F3N2O/c1-20(2,15-8-4-3-5-9-15)14-21(28,22(23,24)25)12-19-17(13-26)16-10-6-7-11-18(16)27-19/h3-11,27-28H,12,14H2,1-2H3