5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid Openeye Name: 5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid CAS Name: 5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid IUPAC Name: 5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid Traditional Name: 5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carboxylic acid Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC4=C(N=C(N4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC4=C(N=C(N4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C21H24N2O2/c24-20(25)18-17(22-19(23-18)16-4-2-1-3-5-16)12-21-9-13-6-14(10-21)8-15(7-13)11-21/h1-5,13-15H,6-12H2,(H,22,23)(H,24,25)