1-ethenyl-7-(2-fluoranylethylamino)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethenyl-7-(2-fluoranylethylamino)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2-fluoroethylamino)-6-nitro-4-oxo-1-vinyl-quinoline-3-carboxylic acid CAS Name: 1-ethenyl-7-(2-fluoroethylamino)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethenyl-7-(2-fluoroethylamino)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2-fluoroethylamino)-4-keto-6-nitro-1-vinyl-quinoline-3-carboxylic acid Formula: C14H12FN3O5 MolecularWeight: 321.260583

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C=C(C(=O)C2=CC(=C(C=C21)NCCF)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C=CN1C=C(C(=O)C2=CC(=C(C=C21)NCCF)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H12FN3O5/c1-2-17-7-9(14(20)21)13(19)8-5-12(18(22)23)10(6-11(8)17)16-4-3-15/h2,5-7,16H,1,3-4H2,(H,20,21)