5-chloranyl-4-oxidanylidene-1-[4-(trifluoromethyloxy)phenyl]-3H-cinnoline-2-carboxylic acid

Systemtic Name: 5-chloranyl-4-oxidanylidene-1-[4-(trifluoromethyloxy)phenyl]-3H-cinnoline-2-carboxylic acid Openeye Name: 5-chloro-4-oxo-1-[4-(trifluoromethoxy)phenyl]-3H-cinnoline-2-carboxylic acid CAS Name: 5-chloro-4-oxo-1-[4-(trifluoromethoxy)phenyl]-3H-cinnoline-2-carboxylic acid IUPAC Name: 5-chloro-4-oxo-1-[4-(trifluoromethoxy)phenyl]-3H-cinnoline-2-carboxylic acid Traditional Name: 5-chloro-4-keto-1-[4-(trifluoromethoxy)phenyl]-3H-cinnoline-2-carboxylic acid Formula: C16H10ClF3N2O4 MolecularWeight: 386.70981

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=C(C=CC=C2Cl)N(N1C(=O)O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1C(=O)C2=C(C=CC=C2Cl)N(N1C(=O)O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C16H10ClF3N2O4/c17-11-2-1-3-12-14(11)13(23)8-21(15(24)25)22(12)9-4-6-10(7-5-9)26-16(18,19)20/h1-7H,8H2,(H,24,25)