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

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-8-methyl-1-(oxetan-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-8-methyl-1-(oxetan-3-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-6-fluoro-8-methyl-1-(3-oxetanyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-8-methyl-1-(oxetan-3-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-6-fluoro-4-keto-8-methyl-1-(oxetan-3-yl)quinoline-3-carboxylic acid Formula: C18H20FN3O4 MolecularWeight: 361.367503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4COC4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4COC4)C(=O)O

InChI

InChI=1S/C18H20FN3O4/c1-9-15-12(4-14(19)16(9)21-3-2-10(20)5-21)17(23)13(18(24)25)6-22(15)11-7-26-8-11/h4,6,10-11H,2-3,5,7-8,20H2,1H3,(H,24,25)