tert-butyl 4-azanylbenzimidazole-1-carboxylate

Systemtic Name: tert-butyl 4-azanylbenzimidazole-1-carboxylate Openeye Name: tert-butyl 4-aminobenzimidazole-1-carboxylate CAS Name: 4-amino-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-aminobenzimidazole-1-carboxylate Traditional Name: 4-aminobenzimidazole-1-carboxylic acid tert-butyl ester Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=NC2=C1C=CC=C2N

Isomeric SMILES

CC(C)(C)OC(=O)N1C=NC2=C1C=CC=C2N

InChI

InChI=1S/C12H15N3O2/c1-12(2,3)17-11(16)15-7-14-10-8(13)5-4-6-9(10)15/h4-7H,13H2,1-3H3