tert-butyl 4-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]benzoate

Systemtic Name: tert-butyl 4-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]benzoate Openeye Name: tert-butyl 4-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]benzoate CAS Name: 4-[[2-butyl-5-(hydroxymethyl)-1-imidazolyl]methyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-butyl-5-(hydroxymethyl)imidazol-1-yl]methyl]benzoate Traditional Name: 4-[(2-butyl-5-methylol-imidazol-1-yl)methyl]benzoic acid tert-butyl ester Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OC(C)(C)C)CO

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C20H28N2O3/c1-5-6-7-18-21-12-17(14-23)22(18)13-15-8-10-16(11-9-15)19(24)25-20(2,3)4/h8-12,23H,5-7,13-14H2,1-4H3