2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-3H-benzimidazole-5-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(N6)C=C(C=C7)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C6=NC7=C(N6)C=C(C=C7)C(=O)O

InChI

InChI=1S/C28H34N4O3/c33-27(34)20-6-7-21-22(11-20)30-26(29-21)24-23(31-25(32-24)19-4-2-1-3-5-19)15-35-28-12-16-8-17(13-28)10-18(9-16)14-28/h6-7,11,16-19H,1-5,8-10,12-15H2,(H,29,30)(H,31,32)(H,33,34)