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

Systemtic Name: ethyl 5-chloranyl-3-[2,2,3,3,3-pentakis(fluoranyl)propylsulfanyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-(2,2,3,3,3-pentafluoropropylsulfanyl)-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(2,2,3,3,3-pentafluoropropylthio)-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-(2,2,3,3,3-pentafluoropropylsulfanyl)-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(2,2,3,3,3-pentafluoropropylthio)-1H-indole-2-carboxylic acid ethyl ester Formula: C14H11ClF5NO2S MolecularWeight: 387.752656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClF5NO2S/c1-2-23-12(22)10-11(24-6-13(16,17)14(18,19)20)8-5-7(15)3-4-9(8)21-10/h3-5,21H,2,6H2,1H3