5-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]carbonylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]carbonylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-fluoro-benzoic acid CAS Name: 5-[[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazol-4-yl]-oxomethyl]amino]-2-fluorobenzoic acid IUPAC Name: 5-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-fluorobenzoic acid Traditional Name: 5-[[5-(1-adamantyloxymethyl)-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-fluoro-benzoic acid Formula: C28H34FN3O4 MolecularWeight: 495.585663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C(=O)NC6=CC(=C(C=C6)F)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC(=C(N2)COC34CC5CC(C3)CC(C5)C4)C(=O)NC6=CC(=C(C=C6)F)C(=O)O

InChI

InChI=1S/C28H34FN3O4/c29-22-7-6-20(11-21(22)27(34)35)30-26(33)24-23(31-25(32-24)19-4-2-1-3-5-19)15-36-28-12-16-8-17(13-28)10-18(9-16)14-28/h6-7,11,16-19H,1-5,8-10,12-15H2,(H,30,33)(H,31,32)(H,34,35)