1-cyclopropyl-6,8-bis(fluoranyl)-5-(methylamino)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-5-(methylamino)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-5-(methylamino)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-4-keto-5-(methylamino)-7-piperazino-quinoline-3-carboxylic acid Formula: C18H20F2N4O3 MolecularWeight: 378.373206

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)F)N4CCNCC4)F

Isomeric SMILES

CNC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)F)N4CCNCC4)F

InChI

InChI=1S/C18H20F2N4O3/c1-21-14-11-15(13(20)16(12(14)19)23-6-4-22-5-7-23)24(9-2-3-9)8-10(17(11)25)18(26)27/h8-9,21-22H,2-7H2,1H3,(H,26,27)