2-[[7-bromanyl-3-(4-fluorophenyl)-6-oxidanylidene-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[7-bromanyl-3-(4-fluorophenyl)-6-oxidanylidene-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[7-bromo-3-(4-fluorophenyl)-6-oxo-4H-quinoxaline-5-carbonyl]amino]acetic acid CAS Name: 2-[[[7-bromo-3-(4-fluorophenyl)-6-oxo-4H-quinoxalin-5-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[7-bromo-3-(4-fluorophenyl)-6-oxo-4H-quinoxaline-5-carbonyl]amino]acetic acid Traditional Name: 2-[[7-bromo-3-(4-fluorophenyl)-6-keto-4H-quinoxaline-5-carbonyl]amino]acetic acid Formula: C17H11BrFN3O4 MolecularWeight: 420.189343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C3C=C(C(=O)C(=C3N2)C(=O)NCC(=O)O)Br)F

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C3C=C(C(=O)C(=C3N2)C(=O)NCC(=O)O)Br)F

InChI

InChI=1S/C17H11BrFN3O4/c18-10-5-11-15(14(16(10)25)17(26)21-7-13(23)24)22-12(6-20-11)8-1-3-9(19)4-2-8/h1-6,22H,7H2,(H,21,26)(H,23,24)