ethyl N-(5-aminocarbonyl-2H-1,2,3-triazol-4-yl)-N-(4-fluoranyl-2-nitro-phenyl)carbamate

Systemtic Name: ethyl N-(5-aminocarbonyl-2H-1,2,3-triazol-4-yl)-N-(4-fluoranyl-2-nitro-phenyl)carbamate Openeye Name: ethyl N-(5-carbamoyl-2H-triazol-4-yl)-N-(4-fluoro-2-nitro-phenyl)carbamate CAS Name: N-(5-carbamoyl-2H-triazol-4-yl)-N-(4-fluoro-2-nitrophenyl)carbamic acid ethyl ester IUPAC Name: ethyl N-(5-carbamoyl-2H-triazol-4-yl)-N-(4-fluoro-2-nitrophenyl)carbamate Traditional Name: N-(5-carbamoyl-2H-triazol-4-yl)-N-(4-fluoro-2-nitro-phenyl)carbamic acid ethyl ester Formula: C12H11FN6O5 MolecularWeight: 338.251343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C1=C(C=C(C=C1)F)[N+](=O)[O-])C2=NNN=C2C(=O)N

Isomeric SMILES

CCOC(=O)N(C1=C(C=C(C=C1)F)[N+](=O)[O-])C2=NNN=C2C(=O)N

InChI

InChI=1S/C12H11FN6O5/c1-2-24-12(21)18(11-9(10(14)20)15-17-16-11)7-4-3-6(13)5-8(7)19(22)23/h3-5H,2H2,1H3,(H2,14,20)(H,15,16,17)