2-[4-(5-fluoranyl-2-oxidanyl-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile

Systemtic Name: 2-[4-(5-fluoranyl-2-oxidanyl-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile Openeye Name: 2-[4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile CAS Name: 2-[4-(5-fluoro-2-hydroxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile IUPAC Name: 2-[4-(5-fluoro-2-hydroxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile Traditional Name: 2-[4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-methyl-1H-indole-6-carbonitrile Formula: C23H22F4N2O2 MolecularWeight: 434.426593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(NC2=CC(=C1)C#N)CC(CC(C)(C)C3=C(C=CC(=C3)F)O)(C(F)(F)F)O

Isomeric SMILES

CC1=C2C=C(NC2=CC(=C1)C#N)CC(CC(C)(C)C3=C(C=CC(=C3)F)O)(C(F)(F)F)O

InChI

InChI=1S/C23H22F4N2O2/c1-13-6-14(11-28)7-19-17(13)9-16(29-19)10-22(31,23(25,26)27)12-21(2,3)18-8-15(24)4-5-20(18)30/h4-9,29-31H,10,12H2,1-3H3