1-ethyl-6-fluoranyl-4-oxidanylidene-1-piperazin-1-yl-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-1-piperazin-1-yl-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-4-oxo-1-piperazin-1-yl-quinolin-1-ium-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-1-(1-piperazinyl)-3-quinolin-1-iumcarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-1-piperazin-1-ylquinolin-1-ium-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-1-piperazino-quinolin-1-ium-3-carboxylic acid Formula: C16H19FN3O3+ MolecularWeight: 320.338763

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)O)N3CCNCC3

Isomeric SMILES

CC[N+]1(C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)O)N3CCNCC3

InChI

InChI=1S/C16H18FN3O3/c1-2-20(19-7-5-18-6-8-19)10-13(16(22)23)15(21)12-9-11(17)3-4-14(12)20/h3-4,9-10,18H,2,5-8H2,1H3/p+1