8-fluoranyl-1-[[4-(6-morpholin-4-ylpyridin-3-yl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-fluoranyl-1-[[4-(6-morpholin-4-ylpyridin-3-yl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-fluoro-1-[[4-(6-morpholino-3-pyridyl)phenyl]methyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-fluoro-1-[[4-[6-(4-morpholinyl)-3-pyridinyl]phenyl]methyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-fluoro-1-[[4-(6-morpholin-4-ylpyridin-3-yl)phenyl]methyl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-fluoro-4-keto-1-[4-(6-morpholino-3-pyridyl)benzyl]quinoline-3-carboxylic acid Formula: C26H22FN3O4 MolecularWeight: 459.468983

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C3=CC=C(C=C3)CN4C=C(C(=O)C5=C4C(=CC=C5)F)C(=O)O

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C3=CC=C(C=C3)CN4C=C(C(=O)C5=C4C(=CC=C5)F)C(=O)O

InChI

InChI=1S/C26H22FN3O4/c27-22-3-1-2-20-24(22)30(16-21(25(20)31)26(32)33)15-17-4-6-18(7-5-17)19-8-9-23(28-14-19)29-10-12-34-13-11-29/h1-9,14,16H,10-13,15H2,(H,32,33)