methyl (2S,4R,5S)-5-(furan-2-yl)-4-iodanyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R,5S)-5-(furan-2-yl)-4-iodanyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R,5S)-5-(2-furyl)-4-iodo-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R,5S)-5-(2-furanyl)-4-iodo-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R,5S)-5-(furan-2-yl)-4-iodo-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S,4R,5S)-5-(2-furyl)-4-iodo-1-tosyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C17H18INO5S MolecularWeight: 475.29799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(C2C3=CC=CO3)I)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](C[C@H]([C@@H]2C3=CC=CO3)I)C(=O)OC

InChI

InChI=1S/C17H18INO5S/c1-11-5-7-12(8-6-11)25(21,22)19-14(17(20)23-2)10-13(18)16(19)15-4-3-9-24-15/h3-9,13-14,16H,10H2,1-2H3/t13-,14+,16-/m1/s1