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

Systemtic Name: ethyl 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate CAS Name: 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Traditional Name: 3-(cyclopropylmethyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid ethyl ester Formula: C23H22F3NO2 MolecularWeight: 401.42149

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)C(F)(F)F)CC4CC4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)C(F)(F)F)CC4CC4

InChI

InChI=1S/C23H22F3NO2/c1-2-29-22(28)21-19(13-15-10-11-15)18-8-3-4-9-20(18)27(21)14-16-6-5-7-17(12-16)23(24,25)26/h3-9,12,15H,2,10-11,13-14H2,1H3