ethyl 2-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]ethanoate

Systemtic Name: ethyl 2-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]ethanoate Openeye Name: ethyl 2-[4-(2-quinolylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]acetate CAS Name: 2-[4-(2-quinolinylmethoxy)-3-(trifluoromethylthio)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]acetate Traditional Name: 2-[4-(2-quinolylmethoxy)-3-(trifluoromethylthio)phenyl]acetic acid ethyl ester Formula: C21H18F3NO3S MolecularWeight: 421.43273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)SC(F)(F)F

Isomeric SMILES

CCOC(=O)CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)SC(F)(F)F

InChI

InChI=1S/C21H18F3NO3S/c1-2-27-20(26)12-14-7-10-18(19(11-14)29-21(22,23)24)28-13-16-9-8-15-5-3-4-6-17(15)25-16/h3-11H,2,12-13H2,1H3