ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-3-methylsulfanyl-2-oxidanylidene-1H-indol-3-yl]propanoate

Systemtic Name: ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-3-methylsulfanyl-2-oxidanylidene-1H-indol-3-yl]propanoate Openeye Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-3-methylsulfanyl-2-oxo-indolin-3-yl]propanoate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-3-(methylthio)-2-oxo-1H-indol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-3-methylsulfanyl-2-oxo-1H-indol-3-yl]propanoate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-keto-3-(methylthio)indolin-3-yl]propionic acid ethyl ester Formula: C21H19ClF3NO4S MolecularWeight: 473.89307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1(C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)NC1=O)SC

Isomeric SMILES

CCOC(=O)C(C)C1(C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)NC1=O)SC

InChI

InChI=1S/C21H19ClF3NO4S/c1-4-29-18(27)11(2)20(31-3)14-10-13(6-7-16(14)26-19(20)28)30-17-8-5-12(9-15(17)22)21(23,24)25/h5-11H,4H2,1-3H3,(H,26,28)