1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(1,2,4-triazol-1-yl)-1-pyrrolidinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-[3-(1,2,4-triazol-1-yl)pyrrolidino]quinoline-3-carboxylic acid Formula: C20H20FN5O4 MolecularWeight: 413.402303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)N4C=NC=N4)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)N4C=NC=N4)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C20H20FN5O4/c1-30-19-16-13(18(27)14(20(28)29)8-25(16)11-2-3-11)6-15(21)17(19)24-5-4-12(7-24)26-10-22-9-23-26/h6,8-12H,2-5,7H2,1H3,(H,28,29)