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Details

Stereochemistry RACEMIC
Molecular Formula C28H33NO3.ClH
Molecular Weight 468.027
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DES(PYRROLIDINYL)DIMETHYLAMINO ORMELOXIFENE HYDROCHLORIDE

SMILES

Cl.COC1=CC2=C(C=C1)[C@H]([C@H](C3=CC=CC=C3)C(C)(C)O2)C4=CC=C(OCCN(C)C)C=C4

InChI

InChIKey=GVCYIHCJGMBMGJ-OUPRKWGVSA-N
InChI=1S/C28H33NO3.ClH/c1-28(2)27(21-9-7-6-8-10-21)26(24-16-15-23(30-5)19-25(24)32-28)20-11-13-22(14-12-20)31-18-17-29(3)4;/h6-16,19,26-27H,17-18H2,1-5H3;1H/t26-,27+;/m1./s1

HIDE SMILES / InChI

Molecular Formula C28H33NO3
Molecular Weight 431.5665
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:41:48 GMT 2023
Edited
by admin
on Sat Dec 16 12:41:48 GMT 2023
Record UNII
5075GR1VFZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DES(PYRROLIDINYL)DIMETHYLAMINO ORMELOXIFENE HYDROCHLORIDE
Common Name English
DES(PYRROLIDINYL)DIMETHYLAMINO CENTCHROMAN HYDROCHLORIDE
Common Name English
ETHANAMINE, 2-(4-(3,4-DIHYDRO-7-METHOXY-2,2-DIMETHYL-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-N,N-DIMETHYL-, HYDROCHLORIDE, TRANS-
Common Name English
ETHANAMINE, 2-(4-(3,4-DIHYDRO-7-METHOXY-2,2-DIMETHYL-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-N,N-DIMETHYL-, HYDROCHLORIDE, TRANS-(±)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12857438
Created by admin on Sat Dec 16 12:41:48 GMT 2023 , Edited by admin on Sat Dec 16 12:41:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID501004666
Created by admin on Sat Dec 16 12:41:48 GMT 2023 , Edited by admin on Sat Dec 16 12:41:48 GMT 2023
PRIMARY
FDA UNII
5075GR1VFZ
Created by admin on Sat Dec 16 12:41:48 GMT 2023 , Edited by admin on Sat Dec 16 12:41:48 GMT 2023
PRIMARY
CAS
84394-08-1
Created by admin on Sat Dec 16 12:41:48 GMT 2023 , Edited by admin on Sat Dec 16 12:41:48 GMT 2023
PRIMARY
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