(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyestra-5(10),9(11)-diene-17-carbonitrile
CAS Registry Number®
33300-19-5
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CAS Name
(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyestra-5(10),9(11)-diene-17-carbonitrileMolecular Formula
C21H27NO3Molecular Mass
341.44Cite this Page
(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyestra-5(10),9(11)-diene-17-carbonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=33300-19-5 (retrieved ) (CAS RN: 33300-19-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H27NO3/c1-19-7-4-16-15-5-9-21(24-10-11-25-21)12-14(15)2-3-17(16)18(19)6-8-20(19,23)13-22/h4,17-18,23H,2-3,5-12H2,1H3/t17-,18+,19+,20+/m1/s1
InChIKey
InChIKey=ITBGBOBQGVJJRT-FYQPLNBISA-N
SMILES
C[C@@]12[C@]([C@]3(C(=CC1)C4=C(CC3)CC5(CC4)OCCO5)[H])(CC[C@@]2(C#N)O)[H]
Canonical SMILES
N#CC1(O)CCC2C3C(=CCC21C)C4=C(CC3)CC5(OCCO5)CC4
Other Names for this Substance
- Estra-5(10),9(11)-diene-17-carbonitrile, 3,3-[1,2-ethanediylbis(oxy)]-17-hydroxy-, (17α)-
- Estra-5(10),9(11)-diene-17β-carbonitrile, 17-hydroxy-3-oxo-, cyclic ethylene acetal
- (17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyestra-5(10),9(11)-diene-17-carbonitrile
- 3,3-Ethylenedioxy-17β-cyano-17α-hydroxy-19-norpregna-5(10),9(11)-diene
