5-azanyl-7-(2-azanyl-6-azaspiro[2.4]heptan-6-yl)-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-7-(2-azanyl-6-azaspiro[2.4]heptan-6-yl)-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-(2-amino-6-azaspiro[2.4]heptan-6-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-(2-amino-6-azaspiro[2.4]heptan-6-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-(2-amino-6-azaspiro[2.4]heptan-6-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(2-amino-6-azaspiro[2.4]heptan-6-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C20H22F2N4O3 MolecularWeight: 404.410486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3F)N)F)N4CCC5(C4)CC5N

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)[C@@H]3C[C@@H]3F)N)F)N4CCC5(C4)CC5N

InChI

InChI=1S/C20H22F2N4O3/c1-8-16-13(18(27)9(19(28)29)6-26(16)11-4-10(11)21)15(24)14(22)17(8)25-3-2-20(7-25)5-12(20)23/h6,10-12H,2-5,7,23-24H2,1H3,(H,28,29)/t10-,11+,12?,20?/m0/s1