ethyl 6-fluoranyl-1-methyl-4-oxidanylidene-7-piperazin-1-yl-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylate

Systemtic Name: ethyl 6-fluoranyl-1-methyl-4-oxidanylidene-7-piperazin-1-yl-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylate Openeye Name: ethyl 6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylate CAS Name: 6-fluoro-1-methyl-4-oxo-7-(1-piperazinyl)-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylate Traditional Name: 6-fluoro-4-keto-1-methyl-7-piperazino-1,3-dihydro-[1,3]thiazeto[3,2-a]quinolin-9-ium-3-carboxylic acid ethyl ester Formula: C18H21FN3O3S+ MolecularWeight: 378.441043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=O)C2=CC(=C(C=C2[N+]3=C1SC3C)N4CCNCC4)F

Isomeric SMILES

CCOC(=O)C1C(=O)C2=CC(=C(C=C2[N+]3=C1SC3C)N4CCNCC4)F

InChI

InChI=1S/C18H21FN3O3S/c1-3-25-18(24)15-16(23)11-8-12(19)14(21-6-4-20-5-7-21)9-13(11)22-10(2)26-17(15)22/h8-10,15,20H,3-7H2,1-2H3/q+1