[1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate

Systemtic Name: [1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate Openeye Name: [2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate CAS Name: 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylic acid [1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate Traditional Name: 7-fluoro-2-keto-3,4-dihydro-1H-quinoline-4-carboxylic acid [2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H22FN3O5 MolecularWeight: 379.382783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C1CC(=O)NC2=C1C=CC(=C2)F

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C1CC(=O)NC2=C1C=CC(=C2)F

InChI

InChI=1S/C18H22FN3O5/c1-9(15(24)21-17(26)22-18(2,3)4)27-16(25)12-8-14(23)20-13-7-10(19)5-6-11(12)13/h5-7,9,12H,8H2,1-4H3,(H,20,23)(H2,21,22,24,26)