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

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(4-ethanoyl-3-methyl-piperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-acetyl-3-methyl-piperazin-1-yl)-5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-acetyl-3-methyl-1-piperazinyl)-5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-acetyl-3-methylpiperazin-1-yl)-5-amino-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-acetyl-3-methyl-piperazino)-5-amino-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H22F2N4O4 MolecularWeight: 420.409886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

Isomeric SMILES

CC1CN(CCN1C(=O)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

InChI

InChI=1S/C20H22F2N4O4/c1-9-7-24(5-6-25(9)10(2)27)18-14(21)16(23)13-17(15(18)22)26(11-3-4-11)8-12(19(13)28)20(29)30/h8-9,11H,3-7,23H2,1-2H3,(H,29,30)