2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid CAS Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1H-benzimidazole-4-carboxylic acid Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C6=NC7=C(C=CC=C7N6)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C6=NC7=C(C=CC=C7N6)C(=O)O

InChI

InChI=1S/C28H34N4O3/c33-27(34)20-7-4-8-21-23(20)31-26(29-21)24-22(30-25(32-24)19-5-2-1-3-6-19)15-35-28-12-16-9-17(13-28)11-18(10-16)14-28/h4,7-8,16-19H,1-3,5-6,9-15H2,(H,29,31)(H,30,32)(H,33,34)