5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-(3-pyrazin-2-ylpyrrolidin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-(3-pyrazin-2-ylpyrrolidin-1-yl)quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(3-pyrazin-2-ylpyrrolidin-1-yl)quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[3-(2-pyrazinyl)-1-pyrrolidinyl]-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(3-pyrazin-2-ylpyrrolidin-1-yl)quinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-(3-pyrazin-2-ylpyrrolidino)quinoline-3-carboxylic acid Formula: C22H22FN5O4 MolecularWeight: 439.439583

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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)C5=NC=CN=C5

Isomeric SMILES

COC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCC(C4)C5=NC=CN=C5

InChI

InChI=1S/C22H22FN5O4/c1-32-21-18-15(20(29)13(22(30)31)10-28(18)12-2-3-12)17(24)16(23)19(21)27-7-4-11(9-27)14-8-25-5-6-26-14/h5-6,8,10-12H,2-4,7,9,24H2,1H3,(H,30,31)