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

Systemtic Name: 1-cyclopropyl-7-(4-ethanoyl-3-methyl-piperazin-1-yl)-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-acetyl-3-methyl-piperazin-1-yl)-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-acetyl-3-methyl-1-piperazinyl)-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-acetyl-3-methylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-acetyl-3-methyl-piperazino)-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)C)F

Isomeric SMILES

CC1CN(CCN1C(=O)C)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)C)F

InChI

InChI=1S/C21H24FN3O4/c1-11-9-23(6-7-24(11)13(3)26)17-8-16-18(12(2)19(17)22)20(27)15(21(28)29)10-25(16)14-4-5-14/h8,10-11,14H,4-7,9H2,1-3H3,(H,28,29)