1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-oxidanylidenepropyl)piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-oxidanylidenepropyl)piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 7-(4-acetonylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(2-oxopropyl)-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(2-oxopropyl)piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 7-(4-acetonylpiperazino)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H22FN3O4 MolecularWeight: 375.394083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)C)F)C(=O)O

InChI

InChI=1S/C19H22FN3O4/c1-3-22-11-14(19(26)27)18(25)13-8-15(20)17(9-16(13)22)23-6-4-21(5-7-23)10-12(2)24/h8-9,11H,3-7,10H2,1-2H3,(H,26,27)