3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid

Systemtic Name: 3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Openeye Name: 3-(4-cyclopropyl-2-thienyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid CAS Name: 3-(4-cyclopropyl-2-thiophenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid IUPAC Name: 3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Traditional Name: 3-(4-cyclopropyl-2-thienyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid Formula: C24H18F3NO2S MolecularWeight: 441.46543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC(=C2)C3=C(N(C4=CC=CC=C43)CC5=CC(=CC=C5)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC1C2=CSC(=C2)C3=C(N(C4=CC=CC=C43)CC5=CC(=CC=C5)C(F)(F)F)C(=O)O

InChI

InChI=1S/C24H18F3NO2S/c25-24(26,27)17-5-3-4-14(10-17)12-28-19-7-2-1-6-18(19)21(22(28)23(29)30)20-11-16(13-31-20)15-8-9-15/h1-7,10-11,13,15H,8-9,12H2,(H,29,30)