5-chloranyl-1-cyclopropyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-chloranyl-1-cyclopropyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-chloro-1-cyclopropyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-chloro-1-cyclopropyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-chloro-1-cyclopropyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-chloro-1-cyclopropyl-6-fluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C18H19ClFN3O3 MolecularWeight: 379.813163

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)Cl)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)Cl)F

InChI

InChI=1S/C18H19ClFN3O3/c1-21-4-6-22(7-5-21)13-8-12-14(15(19)16(13)20)17(24)11(18(25)26)9-23(12)10-2-3-10/h8-10H,2-7H2,1H3,(H,25,26)