7-(3-azanylpiperidin-1-yl)-1,8-dicyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpiperidin-1-yl)-1,8-dicyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-1-piperidyl)-1,8-dicyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-piperidinyl)-1,8-dicyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopiperidin-1-yl)-1,8-dicyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopiperidino)-1,8-dicyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H24FN3O3 MolecularWeight: 385.431963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2C4CC4)N(C=C(C3=O)C(=O)O)C5CC5)F)N

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2C4CC4)N(C=C(C3=O)C(=O)O)C5CC5)F)N

InChI

InChI=1S/C21H24FN3O3/c22-16-8-14-18(25(13-5-6-13)10-15(20(14)26)21(27)28)17(11-3-4-11)19(16)24-7-1-2-12(23)9-24/h8,10-13H,1-7,9,23H2,(H,27,28)