3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid

Systemtic Name: 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Openeye Name: 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid CAS Name: 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid IUPAC Name: 3-(cyclopropylmethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Traditional Name: 3-(cyclopropylmethyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid Formula: C21H18F3NO2 MolecularWeight: 373.36833

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC1CC2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C21H18F3NO2/c22-21(23,24)15-5-3-4-14(10-15)12-25-18-7-2-1-6-16(18)17(11-13-8-9-13)19(25)20(26)27/h1-7,10,13H,8-9,11-12H2,(H,26,27)