ethyl 4-[[6-(dioxidanylamino)-1H-benzimidazol-2-yl]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[6-(dioxidanylamino)-1H-benzimidazol-2-yl]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[6-(hydroperoxyamino)-1H-benzimidazol-2-yl]methyl]cyclohexanecarboxylate CAS Name: 4-[[6-(hydroperoxyamino)-1H-benzimidazol-2-yl]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[6-(hydroperoxyamino)-1H-benzimidazol-2-yl]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[6-(hydroperoxyamino)-1H-benzimidazol-2-yl]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CC2=NC3=C(N2)C=C(C=C3)NOO

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CC2=NC3=C(N2)C=C(C=C3)NOO

InChI

InChI=1S/C17H23N3O4/c1-2-23-17(21)12-5-3-11(4-6-12)9-16-18-14-8-7-13(20-24-22)10-15(14)19-16/h7-8,10-12,20,22H,2-6,9H2,1H3,(H,18,19)