6-fluoranyl-1-(4-fluorophenyl)-7-(morpholin-4-ylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(4-fluorophenyl)-7-(morpholin-4-ylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(4-fluorophenyl)-7-(morpholinoamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(4-fluorophenyl)-7-(4-morpholinylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(4-fluorophenyl)-7-(morpholin-4-ylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(4-fluorophenyl)-4-keto-7-(morpholinoamino)quinoline-3-carboxylic acid Formula: C20H17F2N3O4 MolecularWeight: 401.363486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Isomeric SMILES

C1COCCN1NC2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C20H17F2N3O4/c21-12-1-3-13(4-2-12)25-11-15(20(27)28)19(26)14-9-16(22)17(10-18(14)25)23-24-5-7-29-8-6-24/h1-4,9-11,23H,5-8H2,(H,27,28)