tert-butyl 3-azanyl-5-nitro-indazole-1-carboxylate

Systemtic Name: tert-butyl 3-azanyl-5-nitro-indazole-1-carboxylate Openeye Name: tert-butyl 3-amino-5-nitro-indazole-1-carboxylate CAS Name: 3-amino-5-nitro-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-5-nitroindazole-1-carboxylate Traditional Name: 3-amino-5-nitro-indazole-1-carboxylic acid tert-butyl ester Formula: C12H14N4O4 MolecularWeight: 278.26396

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4/c1-12(2,3)20-11(17)15-9-5-4-7(16(18)19)6-8(9)10(13)14-15/h4-6H,1-3H3,(H2,13,14)