(phenylmethyl) 2-methyl-4-methylsulfonyloxy-2-[(E)-4-oxidanylbut-2-enoxy]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-4-methylsulfonyloxy-2-[(E)-4-oxidanylbut-2-enoxy]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[(E)-4-hydroxybut-2-enoxy]-2-methyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[(E)-4-hydroxybut-2-enoxy]-2-methyl-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(E)-4-hydroxybut-2-enoxy]-2-methyl-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-[(E)-4-hydroxybut-2-enoxy]-2-methyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid benzyl ester Formula: C18H25NO7S MolecularWeight: 399.4586

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C)OCC=CCO

Isomeric SMILES

CC1(CC(CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C)OC/C=C/CO

InChI

InChI=1S/C18H25NO7S/c1-18(25-11-7-6-10-20)12-16(26-27(2,22)23)13-19(18)17(21)24-14-15-8-4-3-5-9-15/h3-9,16,20H,10-14H2,1-2H3/b7-6+