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4-oxidanylidene-2-(phenylmethyl)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

4-oxidanylidene-2-(phenylmethyl)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

Systemtic Name:4-oxidanylidene-2-(phenylmethyl)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
Openeye Name:2-benzyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
CAS Name:4-oxo-2-(phenylmethyl)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
IUPAC Name:2-benzyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
Traditional Name:2-benzyl-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
Formula: C18H12F3NO3
MolecularWeight: 347.28799
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C(=O)C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C(=O)C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)O


InChI

InChI=1S/C18H12F3NO3/c19-18(20,21)12-8-4-7-11-15(12)22-13(14(16(11)23)17(24)25)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,22,23)(H,24,25)


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