tert-butyl 2-butyl-6-oxidanyl-1H-benzimidazole-4-carboxylate

Systemtic Name: tert-butyl 2-butyl-6-oxidanyl-1H-benzimidazole-4-carboxylate Openeye Name: tert-butyl 2-butyl-6-hydroxy-1H-benzimidazole-4-carboxylate CAS Name: 2-butyl-6-hydroxy-1H-benzimidazole-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-butyl-6-hydroxy-1H-benzimidazole-4-carboxylate Traditional Name: 2-butyl-6-hydroxy-1H-benzimidazole-4-carboxylic acid tert-butyl ester Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1)C=C(C=C2C(=O)OC(C)(C)C)O

Isomeric SMILES

CCCCC1=NC2=C(N1)C=C(C=C2C(=O)OC(C)(C)C)O

InChI

InChI=1S/C16H22N2O3/c1-5-6-7-13-17-12-9-10(19)8-11(14(12)18-13)15(20)21-16(2,3)4/h8-9,19H,5-7H2,1-4H3,(H,17,18)