tert-butyl 2-[acetyloxy-(2,6-dimethylphenyl)methyl]-2-imidazol-1-yl-pentanoate

Systemtic Name: tert-butyl 2-[acetyloxy-(2,6-dimethylphenyl)methyl]-2-imidazol-1-yl-pentanoate Openeye Name: tert-butyl 2-[acetoxy-(2,6-dimethylphenyl)methyl]-2-imidazol-1-yl-pentanoate CAS Name: 2-[acetyloxy-(2,6-dimethylphenyl)methyl]-2-(1-imidazolyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[acetyloxy-(2,6-dimethylphenyl)methyl]-2-imidazol-1-ylpentanoate Traditional Name: 2-[acetoxy-(2,6-dimethylphenyl)methyl]-2-imidazol-1-yl-valeric acid tert-butyl ester Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C1=C(C=CC=C1C)C)OC(=O)C)(C(=O)OC(C)(C)C)N2C=CN=C2

Isomeric SMILES

CCCC(C(C1=C(C=CC=C1C)C)OC(=O)C)(C(=O)OC(C)(C)C)N2C=CN=C2

InChI

InChI=1S/C23H32N2O4/c1-8-12-23(25-14-13-24-15-25,21(27)29-22(5,6)7)20(28-18(4)26)19-16(2)10-9-11-17(19)3/h9-11,13-15,20H,8,12H2,1-7H3