(3S)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-2,3-dihydroquinoline-3-carboxylate

Systemtic Name: (3S)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-2,3-dihydroquinoline-3-carboxylate Openeye Name: (3S)-7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-2,3-dihydroquinoline-3-carboxylate CAS Name: (3S)-7-(4-acetyl-1-piperazinyl)-1-ethyl-6-fluoro-4-oxo-2,3-dihydroquinoline-3-carboxylate IUPAC Name: (3S)-7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-2,3-dihydroquinoline-3-carboxylate Traditional Name: (3S)-7-(4-acetylpiperazino)-1-ethyl-6-fluoro-4-keto-2,3-dihydroquinoline-3-carboxylate Formula: C18H21FN3O4- MolecularWeight: 362.375443

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)[O-]

Isomeric SMILES

CCN1C[C@@H](C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)[O-]

InChI

InChI=1S/C18H22FN3O4/c1-3-20-10-13(18(25)26)17(24)12-8-14(19)16(9-15(12)20)22-6-4-21(5-7-22)11(2)23/h8-9,13H,3-7,10H2,1-2H3,(H,25,26)/p-1/t13-/m0/s1