7-(3-azanylpiperazin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpiperazin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopiperazin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-piperazinyl)-8-chloro-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopiperazin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopiperazino)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C18H20ClFN4O3 MolecularWeight: 394.827803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1F)N3CCNC(C3)N)Cl)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CC1=C2C(=C(C(=C1F)N3CCNC(C3)N)Cl)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C18H20ClFN4O3/c1-8-12-15(24(9-2-3-9)6-10(17(12)25)18(26)27)13(19)16(14(8)20)23-5-4-22-11(21)7-23/h6,9,11,22H,2-5,7,21H2,1H3,(H,26,27)