(phenylmethyl) 2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-enoxy]methyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-enoxy]methyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[[(E)-4-ethoxy-4-oxo-but-2-enoxy]methyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[[(E)-4-ethoxy-4-oxobut-2-enoxy]methyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(E)-4-ethoxy-4-oxobut-2-enoxy]methyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-[[(E)-4-ethoxy-4-keto-but-2-enoxy]methyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid benzyl ester Formula: C20H27NO8S MolecularWeight: 441.49528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCOCC1CC(CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)/C=C/COCC1CC(CN1C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C20H27NO8S/c1-3-27-19(22)10-7-11-26-15-17-12-18(29-30(2,24)25)13-21(17)20(23)28-14-16-8-5-4-6-9-16/h4-10,17-18H,3,11-15H2,1-2H3/b10-7+