1-ethyl-2-oxidanylidene-3-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoxaline-6-carboxylic acid

Systemtic Name: 1-ethyl-2-oxidanylidene-3-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoxaline-6-carboxylic acid Openeye Name: 1-ethyl-2-oxo-3-[(E)-2-[3-(trifluoromethyl)phenyl]vinyl]quinoxaline-6-carboxylic acid CAS Name: 1-ethyl-2-oxo-3-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]-6-quinoxalinecarboxylic acid IUPAC Name: 1-ethyl-2-oxo-3-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]quinoxaline-6-carboxylic acid Traditional Name: 1-ethyl-2-keto-3-[(E)-2-[3-(trifluoromethyl)phenyl]vinyl]quinoxaline-6-carboxylic acid Formula: C20H15F3N2O3 MolecularWeight: 388.33991

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)O)N=C(C1=O)C=CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)O)N=C(C1=O)/C=C/C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3N2O3/c1-2-25-17-9-7-13(19(27)28)11-16(17)24-15(18(25)26)8-6-12-4-3-5-14(10-12)20(21,22)23/h3-11H,2H2,1H3,(H,27,28)/b8-6+