7-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(6-chloro-2-pyridyl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(6-chloro-2-pyridinyl)-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(6-chloropyridin-2-yl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(6-chloro-2-pyridyl)piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H20ClFN4O3 MolecularWeight: 442.870603

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C5=NC(=CC=C5)Cl)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C5=NC(=CC=C5)Cl)F)C(=O)O

InChI

InChI=1S/C22H20ClFN4O3/c23-19-2-1-3-20(25-19)27-8-6-26(7-9-27)18-11-17-14(10-16(18)24)21(29)15(22(30)31)12-28(17)13-4-5-13/h1-3,10-13H,4-9H2,(H,30,31)