ethyl 5-chloranyl-3-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-(2,2,2-trifluoroethylsulfanyl)-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(2,2,2-trifluoroethylthio)-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-(2,2,2-trifluoroethylsulfanyl)-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(2,2,2-trifluoroethylthio)-1H-indole-2-carboxylic acid ethyl ester Formula: C13H11ClF3NO2S MolecularWeight: 337.74515

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SCC(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)SCC(F)(F)F

InChI

InChI=1S/C13H11ClF3NO2S/c1-2-20-12(19)10-11(21-6-13(15,16)17)8-5-7(14)3-4-9(8)18-10/h3-5,18H,2,6H2,1H3