1-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)-2-oxidanylidene-1,2,3-triazinan-2-ium-4,6-dione

Systemtic Name: 1-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)-2-oxidanylidene-1,2,3-triazinan-2-ium-4,6-dione Openeye Name: 1-(5-amino-2-chloro-4-fluoro-phenyl)-2-oxo-triazinan-2-ium-4,6-dione CAS Name: 1-(5-amino-2-chloro-4-fluorophenyl)-2-oxotriazinan-2-ium-4,6-dione IUPAC Name: 1-(5-amino-2-chloro-4-fluorophenyl)-2-oxotriazinan-2-ium-4,6-dione Traditional Name: 1-(5-amino-2-chloro-4-fluoro-phenyl)-2-keto-triazinan-2-ium-4,6-quinone Formula: C9H7ClFN4O3+ MolecularWeight: 273.628283

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N[N+](=O)N(C1=O)C2=CC(=C(C=C2Cl)F)N

Isomeric SMILES

C1C(=O)N[N+](=O)N(C1=O)C2=CC(=C(C=C2Cl)F)N

InChI

InChI=1S/C9H6ClFN4O3/c10-4-1-5(11)6(12)2-7(4)14-9(17)3-8(16)13-15(14)18/h1-2H,3,12H2/p+1