7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(2-methylbut-3-yn-2-yl)-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(2-methylbut-3-yn-2-yl)-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-(1,1-dimethylprop-2-ynyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-6-fluoro-1-(2-methylbut-3-yn-2-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-(2-methylbut-3-yn-2-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-1-(1,1-dimethylprop-2-ynyl)-6-fluoro-4-keto-1,8-naphthyridine-3-carboxylic acid Formula: C18H19FN4O3 MolecularWeight: 358.366863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(C3)N)F)C(=O)O

Isomeric SMILES

CC(C)(C#C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(C3)N)F)C(=O)O

InChI

InChI=1S/C18H19FN4O3/c1-4-18(2,3)23-9-12(17(25)26)14(24)11-7-13(19)16(21-15(11)23)22-6-5-10(20)8-22/h1,7,9-10H,5-6,8,20H2,2-3H3,(H,25,26)