4-oxidanylidene-1-phenyl-5-(trifluoromethyl)cinnoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-phenyl-5-(trifluoromethyl)cinnoline-3-carboxylic acid Openeye Name: 4-oxo-1-phenyl-5-(trifluoromethyl)cinnoline-3-carboxylic acid CAS Name: 4-oxo-1-phenyl-5-(trifluoromethyl)-3-cinnolinecarboxylic acid IUPAC Name: 4-oxo-1-phenyl-5-(trifluoromethyl)cinnoline-3-carboxylic acid Traditional Name: 4-keto-1-phenyl-5-(trifluoromethyl)cinnoline-3-carboxylic acid Formula: C16H9F3N2O3 MolecularWeight: 334.24947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC(=C3C(=O)C(=N2)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC(=C3C(=O)C(=N2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C16H9F3N2O3/c17-16(18,19)10-7-4-8-11-12(10)14(22)13(15(23)24)20-21(11)9-5-2-1-3-6-9/h1-8H,(H,23,24)