7-[(7S)-7-azaniumyl-5-azaspiro[2.4]heptan-5-yl]-5-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 7-[(7S)-7-azaniumyl-5-azaspiro[2.4]heptan-5-yl]-5-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 5-amino-7-[(7S)-7-azaniumyl-5-azaspiro[2.4]heptan-5-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-quinoline-3-carboxylate CAS Name: 5-amino-7-[(7S)-7-ammonio-5-azaspiro[2.4]heptan-5-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-3-quinolinecarboxylate IUPAC Name: 5-amino-7-[(7S)-7-azaniumyl-5-azaspiro[2.4]heptan-5-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxoquinoline-3-carboxylate Traditional Name: 5-amino-7-[(7S)-7-ammonio-5-azaspiro[2.4]heptan-5-yl]-1-cyclopropyl-6-fluoro-4-keto-8-methyl-quinoline-3-carboxylate Formula: C20H23FN4O3 MolecularWeight: 386.420023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)[O-])C3CC3)N)F)N4CC(C5(C4)CC5)[NH3+]

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)[O-])C3CC3)N)F)N4C[C@H](C5(C4)CC5)[NH3+]

InChI

InChI=1S/C20H23FN4O3/c1-9-16-13(18(26)11(19(27)28)6-25(16)10-2-3-10)15(23)14(21)17(9)24-7-12(22)20(8-24)4-5-20/h6,10,12H,2-5,7-8,22-23H2,1H3,(H,27,28)/t12-/m1/s1