tert-butyl 5-[(2-methanoyl-5-methyl-2-propyl-imidazol-4-yl)methyl]-2-phenyl-benzoate

Systemtic Name: tert-butyl 5-[(2-methanoyl-5-methyl-2-propyl-imidazol-4-yl)methyl]-2-phenyl-benzoate Openeye Name: tert-butyl 5-[(2-formyl-5-methyl-2-propyl-imidazol-4-yl)methyl]-2-phenyl-benzoate CAS Name: 5-[(2-formyl-5-methyl-2-propyl-4-imidazolyl)methyl]-2-phenylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(2-formyl-5-methyl-2-propylimidazol-4-yl)methyl]-2-phenylbenzoate Traditional Name: 5-[(2-formyl-5-methyl-2-propyl-imidazol-4-yl)methyl]-2-phenyl-benzoic acid tert-butyl ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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