bis(phenylmethyl) 5-[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: bis(phenylmethyl) 5-[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dibenzyl 5-[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazol-4-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 5-[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[5-(1-adamantylmethyl)-2-phenyl-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid dibenzyl ester Formula: C43H41N3O5 MolecularWeight: 679.80274

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC4=C(N=C(N4)C5=CC=CC=C5)C(=O)NC6=CC(=CC(=C6)C(=O)OCC7=CC=CC=C7)C(=O)OCC8=CC=CC=C8

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC4=C(N=C(N4)C5=CC=CC=C5)C(=O)NC6=CC(=CC(=C6)C(=O)OCC7=CC=CC=C7)C(=O)OCC8=CC=CC=C8

InChI

InChI=1S/C43H41N3O5/c47-40(38-37(45-39(46-38)33-14-8-3-9-15-33)25-43-22-30-16-31(23-43)18-32(17-30)24-43)44-36-20-34(41(48)50-26-28-10-4-1-5-11-28)19-35(21-36)42(49)51-27-29-12-6-2-7-13-29/h1-15,19-21,30-32H,16-18,22-27H2,(H,44,47)(H,45,46)