7-[3-(2,2-dimethylpropylideneamino)pyrrolidin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(2,2-dimethylpropylideneamino)pyrrolidin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(2,2-dimethylpropylideneamino)pyrrolidin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(2,2-dimethylpropylideneamino)-1-pyrrolidinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(2,2-dimethylpropylideneamino)pyrrolidin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[3-(neopentylideneamino)pyrrolidino]quinoline-3-carboxylic acid Formula: C21H26FN3O3 MolecularWeight: 387.447843

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(C3)N=CC(C)(C)C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(C3)N=CC(C)(C)C)F)C(=O)O

InChI

InChI=1S/C21H26FN3O3/c1-5-24-11-15(20(27)28)19(26)14-8-16(22)18(9-17(14)24)25-7-6-13(10-25)23-12-21(2,3)4/h8-9,11-13H,5-7,10H2,1-4H3,(H,27,28)