(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyandrost-5-ene-17-carbonitrile

CAS Registry Number®

83196-58-1
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CAS Name

(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyandrost-5-ene-17-carbonitrile

Molecular Formula

C22H31NO3

Molecular Mass

357.49

Cite this Page

(17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyandrost-5-ene-17-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83196-58-1 (retrieved 2024-08-20) (CAS RN: 83196-58-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H31NO3/c1-19-9-10-22(25-11-12-26-22)13-15(19)3-4-16-17(19)5-7-20(2)18(16)6-8-21(20,24)14-23/h3,16-18,24H,4-13H2,1-2H3/t16-,17+,18+,19+,20+,21+/m1/s1

InChIKey

InChIKey=VRSHJJXUDZAQKD-CEGNMAFCSA-N

SMILES

C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(=CC3)CC5(CC4)OCCO5)[H])[H])(CC[C@@]2(C#N)O)[H]

Canonical SMILES

N#CC1(O)CCC2C3CC=C4CC5(OCCO5)CCC4(C)C3CCC21C

Other Names for this Substance

  • Androst-5-ene-17-carbonitrile, 3,3-[1,2-ethanediylbis(oxy)]-17-hydroxy-, (17α)-
  • (17α)-3,3-[1,2-Ethanediylbis(oxy)]-17-hydroxyandrost-5-ene-17-carbonitrile