2,2-dimethylpropanoyloxymethyl 2-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]-5-phenyl-benzoate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 2-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]-5-phenyl-benzoate Openeye Name: 2,2-dimethylpropanoyloxymethyl 2-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]-5-phenyl-benzoate CAS Name: 2-[[2-butyl-5-chloro-4-(hydroxymethyl)-1-imidazolyl]methyl]-5-phenylbenzoic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 2-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]-5-phenylbenzoate Traditional Name: 2-[(2-butyl-5-chloro-4-methylol-imidazol-1-yl)methyl]-5-phenyl-benzoic acid pivaloyloxymethyl ester Formula: C28H33ClN2O5 MolecularWeight: 513.02502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=C(C=C(C=C2)C3=CC=CC=C3)C(=O)OCOC(=O)C(C)(C)C)Cl)CO

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=C(C=C(C=C2)C3=CC=CC=C3)C(=O)OCOC(=O)C(C)(C)C)Cl)CO

InChI

InChI=1S/C28H33ClN2O5/c1-5-6-12-24-30-23(17-32)25(29)31(24)16-21-14-13-20(19-10-8-7-9-11-19)15-22(21)26(33)35-18-36-27(34)28(2,3)4/h7-11,13-15,32H,5-6,12,16-18H2,1-4H3