7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-8-methoxy-1-(oxetan-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-8-methoxy-1-(oxetan-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-8-methoxy-1-(oxetan-3-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-6-fluoro-8-methoxy-1-(3-oxetanyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-8-methoxy-1-(oxetan-3-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-6-fluoro-4-keto-8-methoxy-1-(oxetan-3-yl)quinoline-3-carboxylic acid Formula: C18H20FN3O5 MolecularWeight: 377.366903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4COC4)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4COC4)C(=O)O

InChI

InChI=1S/C18H20FN3O5/c1-26-17-14-11(4-13(19)15(17)21-3-2-9(20)5-21)16(23)12(18(24)25)6-22(14)10-7-27-8-10/h4,6,9-10H,2-3,5,7-8,20H2,1H3,(H,24,25)