3-[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazol-4-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 3-[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazol-4-yl]carbonylamino]methyl]benzoic acid Openeye Name: 3-[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazole-4-carbonyl]amino]methyl]benzoic acid CAS Name: 3-[[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazol-4-yl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 3-[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazole-4-carbonyl]amino]methyl]benzoic acid Traditional Name: 3-[[[5-[2-(1-adamantyl)ethyl]-2-phenyl-1H-imidazole-4-carbonyl]amino]methyl]benzoic acid Formula: C30H33N3O3 MolecularWeight: 483.60132

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC=CC=C5)C(=O)NCC6=CC=CC(=C6)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC=CC=C5)C(=O)NCC6=CC=CC(=C6)C(=O)O

InChI

InChI=1S/C30H33N3O3/c34-28(31-18-19-5-4-8-24(14-19)29(35)36)26-25(32-27(33-26)23-6-2-1-3-7-23)9-10-30-15-20-11-21(16-30)13-22(12-20)17-30/h1-8,14,20-22H,9-13,15-18H2,(H,31,34)(H,32,33)(H,35,36)