dimethyl 2-[(E,2R)-4-(phenylsulfonyl)but-3-en-2-yl]propanedioate

Systemtic Name: dimethyl 2-[(E,2R)-4-(phenylsulfonyl)but-3-en-2-yl]propanedioate Openeye Name: dimethyl 2-[(E,1R)-3-(benzenesulfonyl)-1-methyl-allyl]propanedioate CAS Name: 2-[(E,2R)-4-(benzenesulfonyl)but-3-en-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E,2R)-4-(benzenesulfonyl)but-3-en-2-yl]propanedioate Traditional Name: 2-[(E,1R)-3-besyl-1-methyl-allyl]malonic acid dimethyl ester Formula: C15H18O6S MolecularWeight: 326.36482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CS(=O)(=O)C1=CC=CC=C1)C(C(=O)OC)C(=O)OC

Isomeric SMILES

C[C@@H](/C=C/S(=O)(=O)C1=CC=CC=C1)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C15H18O6S/c1-11(13(14(16)20-2)15(17)21-3)9-10-22(18,19)12-7-5-4-6-8-12/h4-11,13H,1-3H3/b10-9+/t11-/m0/s1