5-[2-(1-adamantyl)ethyl]-2-(2,4,6-trimethylphenyl)-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-[2-(1-adamantyl)ethyl]-2-(2,4,6-trimethylphenyl)-1H-imidazole-4-carboxylic acid Openeye Name: 5-[2-(1-adamantyl)ethyl]-2-(2,4,6-trimethylphenyl)-1H-imidazole-4-carboxylic acid CAS Name: 5-[2-(1-adamantyl)ethyl]-2-(2,4,6-trimethylphenyl)-1H-imidazole-4-carboxylic acid IUPAC Name: 5-[2-(1-adamantyl)ethyl]-2-(2,4,6-trimethylphenyl)-1H-imidazole-4-carboxylic acid Traditional Name: 5-[2-(1-adamantyl)ethyl]-2-mesityl-1H-imidazole-4-carboxylic acid Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=NC(=C(N2)CCC34CC5CC(C3)CC(C5)C4)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=NC(=C(N2)CCC34CC5CC(C3)CC(C5)C4)C(=O)O)C

InChI

InChI=1S/C25H32N2O2/c1-14-6-15(2)21(16(3)7-14)23-26-20(22(27-23)24(28)29)4-5-25-11-17-8-18(12-25)10-19(9-17)13-25/h6-7,17-19H,4-5,8-13H2,1-3H3,(H,26,27)(H,28,29)