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

Systemtic Name: ethyl 5-acetyloxy-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 5-acetoxy-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate CAS Name: 5-acetyloxy-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyloxy-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Traditional Name: 5-acetoxy-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid ethyl ester Formula: C21H18F3NO4 MolecularWeight: 405.36713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18F3NO4/c1-3-28-20(27)19-11-15-10-17(29-13(2)26)7-8-18(15)25(19)12-14-5-4-6-16(9-14)21(22,23)24/h4-11H,3,12H2,1-2H3