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

Systemtic Name: 7-[4-(2-azanylethanoyl)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-aminoacetyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(2-amino-1-oxoethyl)-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-aminoacetyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-(4-glycylpiperazino)-4-keto-quinoline-3-carboxylic acid Formula: C18H21FN4O4 MolecularWeight: 376.382143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21FN4O4/c1-2-21-10-12(18(26)27)17(25)11-7-13(19)15(8-14(11)21)22-3-5-23(6-4-22)16(24)9-20/h7-8,10H,2-6,9,20H2,1H3,(H,26,27)