[(2S)-1-oxidanylidene-1-[(2-propan-2-yl-1H-pyrazol-2-ium-3-yl)amino]propan-2-yl] 6-fluoranyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(2-propan-2-yl-1H-pyrazol-2-ium-3-yl)amino]propan-2-yl] 6-fluoranyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: [(1S)-2-[(2-isopropyl-1H-pyrazol-2-ium-3-yl)amino]-1-methyl-2-oxo-ethyl] 6-fluoro-4-oxo-chromene-2-carboxylate CAS Name: 6-fluoro-4-oxo-1-benzopyran-2-carboxylic acid [(2S)-1-oxo-1-[(2-propan-2-yl-1H-pyrazol-2-ium-3-yl)amino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-[(2-propan-2-yl-1H-pyrazol-2-ium-3-yl)amino]propan-2-yl] 6-fluoro-4-oxochromene-2-carboxylate Traditional Name: 6-fluoro-4-keto-chromene-2-carboxylic acid [(1S)-2-[(2-isopropyl-1H-pyrazol-2-ium-3-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C19H19FN3O5+ MolecularWeight: 388.369663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(C=CN1)NC(=O)C(C)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)F

Isomeric SMILES

C[C@@H](C(=O)NC1=[N+](NC=C1)C(C)C)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)F

InChI

InChI=1S/C19H18FN3O5/c1-10(2)23-17(6-7-21-23)22-18(25)11(3)27-19(26)16-9-14(24)13-8-12(20)4-5-15(13)28-16/h4-11H,1-3H3,(H,21,22,25)/p+1/t11-/m0/s1