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4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoic acid

4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoic acid

Systemtic Name:4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoic acid
Openeye Name:4-[[2-(trifluoromethyl)-4-quinolyl]methyl]benzoic acid
CAS Name:4-[[2-(trifluoromethyl)-4-quinolinyl]methyl]benzoic acid
IUPAC Name:4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoic acid
Traditional Name:4-[[2-(trifluoromethyl)-4-quinolyl]methyl]benzoic acid
Formula: C18H12F3NO2
MolecularWeight: 331.28859
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)CC3=CC=C(C=C3)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)CC3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C18H12F3NO2/c19-18(20,21)16-10-13(14-3-1-2-4-15(14)22-16)9-11-5-7-12(8-6-11)17(23)24/h1-8,10H,9H2,(H,23,24)


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