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

Systemtic Name: (2R,3S,5S)-5-ethyl-3-iodanyl-1-(4-methylphenyl)sulfonyl-2-pentyl-pyrrolidine Openeye Name: (2R,3S,5S)-5-ethyl-3-iodo-2-pentyl-1-(p-tolylsulfonyl)pyrrolidine CAS Name: (2R,3S,5S)-5-ethyl-3-iodo-1-(4-methylphenyl)sulfonyl-2-pentylpyrrolidine IUPAC Name: (2R,3S,5S)-5-ethyl-3-iodo-1-(4-methylphenyl)sulfonyl-2-pentylpyrrolidine Traditional Name: (2R,3S,5S)-2-amyl-5-ethyl-3-iodo-1-tosyl-pyrrolidine Formula: C18H28INO2S MolecularWeight: 449.38989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28INO2S/c1-4-6-7-8-18-17(19)13-15(5-2)20(18)23(21,22)16-11-9-14(3)10-12-16/h9-12,15,17-18H,4-8,13H2,1-3H3/t15-,17-,18+/m0/s1