2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid

Systemtic Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid Openeye Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid CAS Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid IUPAC Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid Traditional Name: 2-[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-1,3-benzoxazole-6-carboxylic acid Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C6=NC7=C(O6)C=C(C=C7)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C6=NC7=C(O6)C=C(C=C7)C(=O)O

InChI

InChI=1S/C28H33N3O4/c32-27(33)20-6-7-21-23(11-20)35-26(30-21)24-22(29-25(31-24)19-4-2-1-3-5-19)15-34-28-12-16-8-17(13-28)10-18(9-16)14-28/h6-7,11,16-19H,1-5,8-10,12-15H2,(H,29,31)(H,32,33)