tert-butyl 4,5-bis(4-cyanophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]imidazole-2-carboxylate

Systemtic Name: tert-butyl 4,5-bis(4-cyanophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]imidazole-2-carboxylate Openeye Name: tert-butyl 1-(2-tert-butoxy-2-oxo-ethyl)-4,5-bis(4-cyanophenyl)imidazole-2-carboxylate CAS Name: 4,5-bis(4-cyanophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4,5-bis(4-cyanophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]imidazole-2-carboxylate Traditional Name: 1-(2-tert-butoxy-2-keto-ethyl)-4,5-bis(4-cyanophenyl)imidazole-2-carboxylic acid tert-butyl ester Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=C(N=C1C(=O)OC(C)(C)C)C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=C(N=C1C(=O)OC(C)(C)C)C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H28N4O4/c1-27(2,3)35-22(33)17-32-24(21-13-9-19(16-30)10-14-21)23(20-11-7-18(15-29)8-12-20)31-25(32)26(34)36-28(4,5)6/h7-14H,17H2,1-6H3