methyl (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4R)-4-methylsulfonyloxy-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C16H23NO8S2 MolecularWeight: 421.48572

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)OS(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C[C@@H]2C(=O)OC)OS(=O)(=O)C

InChI

InChI=1S/C16H23NO8S2/c1-4-9-24-12-5-7-14(8-6-12)27(21,22)17-11-13(25-26(3,19)20)10-15(17)16(18)23-2/h5-8,13,15H,4,9-11H2,1-3H3/t13-,15-/m1/s1