5-Heptenoic acid, 7-[3-[[[4-(iodo-125I)phenyl]sulfonyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, [1S-[1α,2β(Z),3α,5α]]-

CAS Registry Number®

133538-59-7

CAS Name

5-Heptenoic acid, 7-[3-[[[4-(iodo-125I)phenyl]sulfonyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, [1S-[1α,2β(Z),3α,5α]]-

Molecular Formula

C22H30INO4S

Cite this Page

5-Heptenoic acid, 7-[3-[[[4-(iodo-125I)phenyl]sulfonyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, [1S-[1α,2β(Z),3α,5α]]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=133538-59-7 (retrieved 2024-11-22) (CAS RN: 133538-59-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H30INO4S/c1-22(2)15-13-19(22)18(7-5-3-4-6-8-21(25)26)20(14-15)24-29(27,28)17-11-9-16(23)10-12-17/h3,5,9-12,15,18-20,24H,4,6-8,13-14H2,1-2H3,(H,25,26)/b5-3-/t15-,18+,19+,20+/m1/s1/i23-2

InChIKey

InChIKey=SZNMERGTFJHNSM-IUUJMIENSA-N

SMILES

C(/C=C\CCCC(O)=O)[C@H]1[C@]2(C(C)(C)[C@](C2)(C[C@@H]1NS(=O)(=O)C3=CC=C([125I])C=C3)[H])[H]

Canonical SMILES

O=C(O)CCCC=CCC1C(NS(=O)(=O)C2=CC=C(I)C=C2)CC3CC1C3(C)C

Other Names for this Substance

  • 5-Heptenoic acid, 7-[3-[[[4-(iodo-125I)phenyl]sulfonyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, [1S-[1α,2β(Z),3α,5α]]-

CAS INSIGHTSTM
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