7-(7-acetyloxy-5-azaspiro[2.4]heptan-5-yl)-8-chloranyl-1-cyclopropyl-1-fluoranyl-4-oxidanylidene-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 7-(7-acetyloxy-5-azaspiro[2.4]heptan-5-yl)-8-chloranyl-1-cyclopropyl-1-fluoranyl-4-oxidanylidene-quinolin-1-ium-3-carboxylic acid Openeye Name: 7-(7-acetoxy-5-azaspiro[2.4]heptan-5-yl)-8-chloro-1-cyclopropyl-1-fluoro-4-oxo-quinolin-1-ium-3-carboxylic acid CAS Name: 7-(7-acetyloxy-5-azaspiro[2.4]heptan-5-yl)-8-chloro-1-cyclopropyl-1-fluoro-4-oxo-3-quinolin-1-iumcarboxylic acid IUPAC Name: 7-(7-acetyloxy-5-azaspiro[2.4]heptan-5-yl)-8-chloro-1-cyclopropyl-1-fluoro-4-oxoquinolin-1-ium-3-carboxylic acid Traditional Name: 7-(7-acetoxy-5-azaspiro[2.4]heptan-5-yl)-8-chloro-1-cyclopropyl-1-fluoro-4-keto-quinolin-1-ium-3-carboxylic acid Formula: C21H21ClFN2O5+ MolecularWeight: 435.853243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CN(CC12CC2)C3=C(C4=C(C=C3)C(=O)C(=C[N+]4(C5CC5)F)C(=O)O)Cl

Isomeric SMILES

CC(=O)OC1CN(CC12CC2)C3=C(C4=C(C=C3)C(=O)C(=C[N+]4(C5CC5)F)C(=O)O)Cl

InChI

InChI=1S/C21H20ClFN2O5/c1-11(26)30-16-8-24(10-21(16)6-7-21)15-5-4-13-18(17(15)22)25(23,12-2-3-12)9-14(19(13)27)20(28)29/h4-5,9,12,16H,2-3,6-8,10H2,1H3/p+1