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Details

Stereochemistry RACEMIC
Molecular Formula C22H31NO4
Molecular Weight 373.4858
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BIS(2-HYDROXY-3-(3,5-DIMETHYLPHENOXY)PROPYL)AMINE

SMILES

CC1=CC(OCC(O)CNCC(O)COC2=CC(C)=CC(C)=C2)=CC(C)=C1

InChI

InChIKey=QEWKNJWBRBAQEU-UHFFFAOYSA-N
InChI=1S/C22H31NO4/c1-15-5-16(2)8-21(7-15)26-13-19(24)11-23-12-20(25)14-27-22-9-17(3)6-18(4)10-22/h5-10,19-20,23-25H,11-14H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C22H31NO4
Molecular Weight 373.4858
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:56:22 GMT 2023
Edited
by admin
on Sat Dec 16 18:56:22 GMT 2023
Record UNII
D3AVU4KBM0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BIS(2-HYDROXY-3-(3,5-DIMETHYLPHENOXY)PROPYL)AMINE
Systematic Name English
METAXALONE RELATED COMPOUND C [USP IMPURITY]
Common Name English
2-PROPANOL, 1,1'-IMINOBIS(3-(3,5-DIMETHYLPHENOXY)-
Systematic Name English
METAXALONE RELATED COMPOUND C [USP-RS]
Common Name English
Code System Code Type Description
PUBCHEM
118989488
Created by admin on Sat Dec 16 18:56:22 GMT 2023 , Edited by admin on Sat Dec 16 18:56:22 GMT 2023
PRIMARY
CAS
805972-34-3
Created by admin on Sat Dec 16 18:56:22 GMT 2023 , Edited by admin on Sat Dec 16 18:56:22 GMT 2023
PRIMARY
FDA UNII
D3AVU4KBM0
Created by admin on Sat Dec 16 18:56:22 GMT 2023 , Edited by admin on Sat Dec 16 18:56:22 GMT 2023
PRIMARY
RS_ITEM_NUM
1396171
Created by admin on Sat Dec 16 18:56:22 GMT 2023 , Edited by admin on Sat Dec 16 18:56:22 GMT 2023
PRIMARY
Related Record Type Details
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