3-[(E)-2-(3-bromanyl-4-fluoranyl-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid

Systemtic Name: 3-[(E)-2-(3-bromanyl-4-fluoranyl-phenyl)ethenyl]-1-ethyl-2-oxidanylidene-quinoxaline-6-carboxylic acid Openeye Name: 3-[(E)-2-(3-bromo-4-fluoro-phenyl)vinyl]-1-ethyl-2-oxo-quinoxaline-6-carboxylic acid CAS Name: 3-[(E)-2-(3-bromo-4-fluorophenyl)ethenyl]-1-ethyl-2-oxo-6-quinoxalinecarboxylic acid IUPAC Name: 3-[(E)-2-(3-bromo-4-fluorophenyl)ethenyl]-1-ethyl-2-oxoquinoxaline-6-carboxylic acid Traditional Name: 3-[(E)-2-(3-bromo-4-fluoro-phenyl)vinyl]-1-ethyl-2-keto-quinoxaline-6-carboxylic acid Formula: C19H14BrFN2O3 MolecularWeight: 417.228463

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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(=C(C=C3)F)Br

Isomeric SMILES

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

InChI

InChI=1S/C19H14BrFN2O3/c1-2-23-17-8-5-12(19(25)26)10-16(17)22-15(18(23)24)7-4-11-3-6-14(21)13(20)9-11/h3-10H,2H2,1H3,(H,25,26)/b7-4+