7-(3-acetamidopyrrolidin-1-yl)-6-fluoranyl-4-oxidanylidene-1-phenyl-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-acetamidopyrrolidin-1-yl)-6-fluoranyl-4-oxidanylidene-1-phenyl-quinoline-3-carboxylic acid Openeye Name: 7-(3-acetamidopyrrolidin-1-yl)-6-fluoro-4-oxo-1-phenyl-quinoline-3-carboxylic acid CAS Name: 7-(3-acetamido-1-pyrrolidinyl)-6-fluoro-4-oxo-1-phenyl-3-quinolinecarboxylic acid IUPAC Name: 7-(3-acetamidopyrrolidin-1-yl)-6-fluoro-4-oxo-1-phenylquinoline-3-carboxylic acid Traditional Name: 7-(3-acetamidopyrrolidino)-6-fluoro-4-keto-1-phenyl-quinoline-3-carboxylic acid Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

Isomeric SMILES

CC(=O)NC1CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

InChI

InChI=1S/C22H20FN3O4/c1-13(27)24-14-7-8-25(11-14)20-10-19-16(9-18(20)23)21(28)17(22(29)30)12-26(19)15-5-3-2-4-6-15/h2-6,9-10,12,14H,7-8,11H2,1H3,(H,24,27)(H,29,30)