2-[4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: 2-[4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]ethanenitrile Openeye Name: 2-[4-[(3-isopropyl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]acetonitrile CAS Name: 2-[4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]acetonitrile IUPAC Name: 2-[4-[(3-propan-2-yl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]acetonitrile Traditional Name: 2-[4-[(3-isopropyl-1H-indol-5-yl)oxy]-3,5-bis(trifluoromethyl)phenyl]acetonitrile Formula: C21H16F6N2O MolecularWeight: 426.354959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)CC#N)C(F)(F)F

Isomeric SMILES

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)CC#N)C(F)(F)F

InChI

InChI=1S/C21H16F6N2O/c1-11(2)15-10-29-18-4-3-13(9-14(15)18)30-19-16(20(22,23)24)7-12(5-6-28)8-17(19)21(25,26)27/h3-4,7-11,29H,5H2,1-2H3