5-[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazol-4-yl]carbonylamino]-2-methyl-benzoic acid

Systemtic Name: 5-[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazol-4-yl]carbonylamino]-2-methyl-benzoic acid Openeye Name: 5-[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-methyl-benzoic acid CAS Name: 5-[[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazol-4-yl]-oxomethyl]amino]-2-methylbenzoic acid IUPAC Name: 5-[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-methylbenzoic acid Traditional Name: 5-[[5-[2-(2-adamantyl)ethyl]-2-cyclohexyl-1H-imidazole-4-carbonyl]amino]-2-methyl-benzoic acid Formula: C30H39N3O3 MolecularWeight: 489.64896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(NC(=N2)C3CCCCC3)CCC4C5CC6CC(C5)CC4C6)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(NC(=N2)C3CCCCC3)CCC4C5CC6CC(C5)CC4C6)C(=O)O

InChI

InChI=1S/C30H39N3O3/c1-17-7-8-23(16-25(17)30(35)36)31-29(34)27-26(32-28(33-27)20-5-3-2-4-6-20)10-9-24-21-12-18-11-19(14-21)15-22(24)13-18/h7-8,16,18-22,24H,2-6,9-15H2,1H3,(H,31,34)(H,32,33)(H,35,36)