5-[2-(1-adamantyl)ethyl]-2-(2-methylphenyl)-1-(phenylmethyl)imidazole-4-carboxylic acid

Systemtic Name: 5-[2-(1-adamantyl)ethyl]-2-(2-methylphenyl)-1-(phenylmethyl)imidazole-4-carboxylic acid Openeye Name: 5-[2-(1-adamantyl)ethyl]-1-benzyl-2-(o-tolyl)imidazole-4-carboxylic acid CAS Name: 5-[2-(1-adamantyl)ethyl]-2-(2-methylphenyl)-1-(phenylmethyl)-4-imidazolecarboxylic acid IUPAC Name: 5-[2-(1-adamantyl)ethyl]-1-benzyl-2-(2-methylphenyl)imidazole-4-carboxylic acid Traditional Name: 5-[2-(1-adamantyl)ethyl]-1-benzyl-2-(o-tolyl)imidazole-4-carboxylic acid Formula: C30H34N2O2 MolecularWeight: 454.60316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(N2CC3=CC=CC=C3)CCC45CC6CC(C4)CC(C6)C5)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(N2CC3=CC=CC=C3)CCC45CC6CC(C4)CC(C6)C5)C(=O)O

InChI

InChI=1S/C30H34N2O2/c1-20-7-5-6-10-25(20)28-31-27(29(33)34)26(32(28)19-21-8-3-2-4-9-21)11-12-30-16-22-13-23(17-30)15-24(14-22)18-30/h2-10,22-24H,11-19H2,1H3,(H,33,34)