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Enclomiphene citrate

CAS Registry Number®

7599-79-3
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CAS Name

Enclomiphene citrate

Molecular Formula

C26H28ClNO.C6H8O7

Cite this Page

Enclomiphene citrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7599-79-3 (retrieved 2023-03-20) (CAS RN: 7599-79-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H28ClNO.C6H8O7/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-18H,3-4,19-20H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b26-25+;

InChIKey

InChIKey=PYTMYKVIJXPNBD-BTKVJIOYSA-N

SMILES

C(CC(O)=O)(CC(O)=O)(C(O)=O)O.C(=C(/Cl)\C1=CC=CC=C1)(\C2=CC=C(OCCN(CC)CC)C=C2)/C3=CC=CC=C3

Canonical SMILES

O=C(O)CC(O)(C(=O)O)CC(=O)O.ClC(C=1C=CC=CC1)=C(C=2C=CC=CC2)C3=CC=C(OCCN(CC)CC)C=C3

Other Names for this Substance

  • Ethanamine, 2-[4-[(1E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • Triethylamine, 2-[p-(2-chloro-1,2-diphenylvinyl)phenoxy]-, citrate (1:1), (E)-
  • Ethanamine, 2-[4-(2-chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethyl-, (E)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • trans-Clomiphene citrate
  • Clomiphene B citrate

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Deleted or Replaced CAS Registry Numbers

96189-17-2, 207562-80-9