1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C2=C1C=CC(=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O)C

Isomeric SMILES

CN1CCN(C2=C1C=CC(=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O)C

InChI

InChI=1S/C21H20FN3O3/c1-23-8-9-24(2)18-10-13(6-7-16(18)23)11-25-12-14(21(27)28)20(26)19-15(22)4-3-5-17(19)25/h3-7,10,12H,8-9,11H2,1-2H3,(H,27,28)