ethyl 5-acetyloxy-1-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate

Systemtic Name: ethyl 5-acetyloxy-1-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 5-acetoxy-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate CAS Name: 5-acetyloxy-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyloxy-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Traditional Name: 5-acetoxy-1-[4-chloro-3-(trifluoromethyl)benzyl]indole-2-carboxylic acid ethyl ester Formula: C21H17ClF3NO4 MolecularWeight: 439.81219

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC3=CC(=C(C=C3)Cl)C(F)(F)F)C=CC(=C2)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC3=CC(=C(C=C3)Cl)C(F)(F)F)C=CC(=C2)OC(=O)C

InChI

InChI=1S/C21H17ClF3NO4/c1-3-29-20(28)19-10-14-9-15(30-12(2)27)5-7-18(14)26(19)11-13-4-6-17(22)16(8-13)21(23,24)25/h4-10H,3,11H2,1-2H3