5-azanyl-1-cyclopropyl-8-ethyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-8-ethyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-8-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-8-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-8-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-8-ethyl-6-fluoro-4-keto-7-piperazino-quinoline-3-carboxylic acid Formula: C19H23FN4O3 MolecularWeight: 374.409323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCNCC4

Isomeric SMILES

CCC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCNCC4

InChI

InChI=1S/C19H23FN4O3/c1-2-11-16-13(15(21)14(20)17(11)23-7-5-22-6-8-23)18(25)12(19(26)27)9-24(16)10-3-4-10/h9-10,22H,2-8,21H2,1H3,(H,26,27)