5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid Openeye Name: 5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid CAS Name: 5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid IUPAC Name: 5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid Traditional Name: 5-[2-(1-adamantyl)ethyl]-2-(3,4-dichlorophenyl)-1H-imidazole-4-carboxylic acid Formula: C22H24Cl2N2O2 MolecularWeight: 419.34416

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC(=C(C=C5)Cl)Cl)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC(=C(C=C5)Cl)Cl)C(=O)O

InChI

InChI=1S/C22H24Cl2N2O2/c23-16-2-1-15(8-17(16)24)20-25-18(19(26-20)21(27)28)3-4-22-9-12-5-13(10-22)7-14(6-12)11-22/h1-2,8,12-14H,3-7,9-11H2,(H,25,26)(H,27,28)