Nombre: 1-amino-4-((tert-butoxycarbonyl)amino)-3-fluoropyridin-1-ium 2,4-dinitrophenolate

IUPAC: tert-butyl N-(1-amino-3-fluoropyridin-1-ium-4-yl)carbamate;2,4-dinitrophenolate

SMILES: CC(C)(C)OC(=O)Nc1cc[n+](N)cc1F.O=[N+]([O-])c1ccc([O-])c([N+](=O)[O-])c1

Canonical SMILES: CC(C)(C)OC(=O)NC1=C(C=[N+](C=C1)N)F.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[O-]

Fórmula molecular: C16H18FN5O7

Masa molecular: 411.34

InChIKey: QZWNVSHHHBQIOW-UHFFFAOYSA-N

InChI:

InChI=1S/C10H14FN3O2.C6H4N2O5/c1-10(2,3)16-9(15)13-8-4-5-14(12)6-7(8)11;9-6-2-1-4(7(10)11)3-5(6)8(12)13/h4-6H,12H2,1-3H3;1-3,9H

Sinónimos

SCHEMBL15017979SCHEMBL30197108QZWNVSHHHBQIOW-UHFFFAOYSA-N1-amino-4-((tert-butoxycarbonyl)amino)-3-fluoropyridin-1-ium 2,4-dinitrophenolate

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