(2R,3S,5R)-5-butyl-3-iodanyl-1-(4-methylphenyl)sulfonyl-2-pentyl-pyrrolidine

Systemtic Name: (2R,3S,5R)-5-butyl-3-iodanyl-1-(4-methylphenyl)sulfonyl-2-pentyl-pyrrolidine Openeye Name: (2R,3S,5R)-5-butyl-3-iodo-2-pentyl-1-(p-tolylsulfonyl)pyrrolidine CAS Name: (2R,3S,5R)-5-butyl-3-iodo-1-(4-methylphenyl)sulfonyl-2-pentylpyrrolidine IUPAC Name: (2R,3S,5R)-5-butyl-3-iodo-1-(4-methylphenyl)sulfonyl-2-pentylpyrrolidine Traditional Name: (2R,3S,5R)-2-amyl-5-butyl-3-iodo-1-tosyl-pyrrolidine Formula: C20H32INO2S MolecularWeight: 477.44305

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(CC(N1S(=O)(=O)C2=CC=C(C=C2)C)CCCC)I

Isomeric SMILES

CCCCC[C@@H]1[C@H](C[C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)CCCC)I

InChI

InChI=1S/C20H32INO2S/c1-4-6-8-10-20-19(21)15-17(9-7-5-2)22(20)25(23,24)18-13-11-16(3)12-14-18/h11-14,17,19-20H,4-10,15H2,1-3H3/t17-,19+,20-/m1/s1