4-[4-(dimethylamino)-2-methyl-8-phenoxy-octoxy]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[4-(dimethylamino)-2-methyl-8-phenoxy-octoxy]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[4-(dimethylamino)-2-methyl-8-phenoxy-octoxy]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[4-(dimethylamino)-2-methyl-8-phenoxyoctoxy]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[4-(dimethylamino)-2-methyl-8-phenoxyoctoxy]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[4-(dimethylamino)-2-methyl-8-phenoxy-octoxy]-2-(trifluoromethyl)benzonitrile Formula: C25H31F3N2O2 MolecularWeight: 448.52105

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CCCCOC1=CC=CC=C1)N(C)C)COC2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CC(CC(CCCCOC1=CC=CC=C1)N(C)C)COC2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C25H31F3N2O2/c1-19(18-32-23-13-12-20(17-29)24(16-23)25(26,27)28)15-21(30(2)3)9-7-8-14-31-22-10-5-4-6-11-22/h4-6,10-13,16,19,21H,7-9,14-15,18H2,1-3H3