tert-butyl 5-bromanyl-3-methyl-2-oxidanylidene-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-3-methyl-2-oxidanylidene-benzimidazole-1-carboxylate Openeye Name: tert-butyl 5-bromo-3-methyl-2-oxo-benzimidazole-1-carboxylate CAS Name: 5-bromo-3-methyl-2-oxo-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-bromo-3-methyl-2-oxobenzimidazole-1-carboxylate Traditional Name: 5-bromo-2-keto-3-methyl-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C13H15BrN2O3 MolecularWeight: 327.1738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Br)N(C1=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Br)N(C1=O)C

InChI

InChI=1S/C13H15BrN2O3/c1-13(2,3)19-12(18)16-9-6-5-8(14)7-10(9)15(4)11(16)17/h5-7H,1-4H3