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

Systemtic Name: 5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[3-(1,2,3-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(1-triazolyl)-1-pyrrolidinyl]-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-[3-(triazol-1-yl)pyrrolidino]quinoline-3-carboxylic acid Formula: C20H21FN6O4 MolecularWeight: 428.416943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCC(C4)N5C=CN=N5

Isomeric SMILES

COC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCC(C4)N5C=CN=N5

InChI

InChI=1S/C20H21FN6O4/c1-31-19-16-13(18(28)12(20(29)30)9-26(16)10-2-3-10)15(22)14(21)17(19)25-6-4-11(8-25)27-7-5-23-24-27/h5,7,9-11H,2-4,6,8,22H2,1H3,(H,29,30)