tert-butyl 5-[2-(5-methyl-2-propyl-1H-imidazol-4-yl)-2-oxidanylidene-ethyl]-2-phenyl-benzoate

Systemtic Name: tert-butyl 5-[2-(5-methyl-2-propyl-1H-imidazol-4-yl)-2-oxidanylidene-ethyl]-2-phenyl-benzoate Openeye Name: tert-butyl 5-[2-(5-methyl-2-propyl-1H-imidazol-4-yl)-2-oxo-ethyl]-2-phenyl-benzoate CAS Name: 5-[2-(5-methyl-2-propyl-1H-imidazol-4-yl)-2-oxoethyl]-2-phenylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-[2-(5-methyl-2-propyl-1H-imidazol-4-yl)-2-oxoethyl]-2-phenylbenzoate Traditional Name: 5-[2-keto-2-(5-methyl-2-propyl-1H-imidazol-4-yl)ethyl]-2-phenyl-benzoic acid tert-butyl ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1)C)C(=O)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=NC(=C(N1)C)C(=O)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H30N2O3/c1-6-10-23-27-17(2)24(28-23)22(29)16-18-13-14-20(19-11-8-7-9-12-19)21(15-18)25(30)31-26(3,4)5/h7-9,11-15H,6,10,16H2,1-5H3,(H,27,28)