[4-(hydroxymethyl)-5-methylsulfonyl-1-(phenylmethyl)imidazol-2-yl]methyl ethanoate

Systemtic Name: [4-(hydroxymethyl)-5-methylsulfonyl-1-(phenylmethyl)imidazol-2-yl]methyl ethanoate Openeye Name: [1-benzyl-4-(hydroxymethyl)-5-methylsulfonyl-imidazol-2-yl]methyl acetate CAS Name: acetic acid [4-(hydroxymethyl)-5-methylsulfonyl-1-(phenylmethyl)-2-imidazolyl]methyl ester IUPAC Name: [1-benzyl-4-(hydroxymethyl)-5-methylsulfonylimidazol-2-yl]methyl acetate Traditional Name: acetic acid (1-benzyl-5-mesyl-4-methylol-imidazol-2-yl)methyl ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=NC(=C(N1CC2=CC=CC=C2)S(=O)(=O)C)CO

Isomeric SMILES

CC(=O)OCC1=NC(=C(N1CC2=CC=CC=C2)S(=O)(=O)C)CO

InChI

InChI=1S/C15H18N2O5S/c1-11(19)22-10-14-16-13(9-18)15(23(2,20)21)17(14)8-12-6-4-3-5-7-12/h3-7,18H,8-10H2,1-2H3