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

Systemtic Name: 1-[[3-(trifluoromethyl)phenyl]methyl]indole-3-carboxylic acid Openeye Name: 1-[[3-(trifluoromethyl)phenyl]methyl]indole-3-carboxylic acid CAS Name: 1-[[3-(trifluoromethyl)phenyl]methyl]-3-indolecarboxylic acid IUPAC Name: 1-[[3-(trifluoromethyl)phenyl]methyl]indole-3-carboxylic acid Traditional Name: 1-[3-(trifluoromethyl)benzyl]indole-3-carboxylic acid Formula: C17H12F3NO2 MolecularWeight: 319.27789

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H12F3NO2/c18-17(19,20)12-5-3-4-11(8-12)9-21-10-14(16(22)23)13-6-1-2-7-15(13)21/h1-8,10H,9H2,(H,22,23)