tert-butyl 3-(2-bromanylethanoyl)-5-nitro-indazole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-bromanylethanoyl)-5-nitro-indazole-1-carboxylate Openeye Name: tert-butyl 3-(2-bromoacetyl)-5-nitro-indazole-1-carboxylate CAS Name: 3-(2-bromo-1-oxoethyl)-5-nitro-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-bromoacetyl)-5-nitroindazole-1-carboxylate Traditional Name: 3-(2-bromoacetyl)-5-nitro-indazole-1-carboxylic acid tert-butyl ester Formula: C14H14BrN3O5 MolecularWeight: 384.18206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C(=O)CBr

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C(=O)CBr

InChI

InChI=1S/C14H14BrN3O5/c1-14(2,3)23-13(20)17-10-5-4-8(18(21)22)6-9(10)12(16-17)11(19)7-15/h4-6H,7H2,1-3H3