NAVIGATION


Clomiphene citrate salt

Catalog Number
ACM50419-2
CAS Number
50-41-9
Product Name
Clomiphene citrate salt
Structure
Category
Salt
IUPAC Name
2-[4-[(Z)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
Molecular Weight
598.1g/mol
Molecular Formula
C32H36ClNO8
Canonical SMILES
CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
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-;
InChI Key
PYTMYKVIJXPNBD-OQKDUQJOSA-N
Complexity
708
Covalently-Bonded Unit Count
2
EC Number
200-035-3
Exact Mass
597.212945g/mol
Formal Charge
0
Heavy Atom Count
42
MeSH Entry Terms
Chloramiphene;Citrate, Clomiphene;Clomid;Clomide;Clomifen;Clomifene;Clomiphene;Clomiphene Citrate;Clomiphene Hydrochloride;Clostilbegit;Dyneric;Gravosan;Hydrochloride, Clomiphene;Klostilbegit;Serophene
Monoisotopic Mass
597.212945g/mol
NSC Number
756698;151466;35770
Rotatable Bond Count
14
UNII
UY5X264QZV
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