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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21NO.C12H26O4S
Molecular Weight 521.752
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIPHENHYDRAMINE LAURYLSULFATE

SMILES

CCCCCCCCCCCCOS(O)(=O)=O.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=AJZFEQIFKBZILH-UHFFFAOYSA-N
InChI=1S/C17H21NO.C12H26O4S/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h3-12,17H,13-14H2,1-2H3;2-12H2,1H3,(H,13,14,15)

HIDE SMILES / InChI

Molecular Formula C17H21NO
Molecular Weight 255.3547
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C12H26O4S
Molecular Weight 266.397
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 04:36:38 UTC 2023
Edited
by admin
on Sat Dec 16 04:36:38 UTC 2023
Record UNII
3E2CN035LB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIPHENHYDRAMINE LAURYLSULFATE
JAN  
Common Name English
SULFURIC ACID, MONODODECYL ESTER, COMPD. WITH 2-(DIPHENYLMETHOXY)-N,N-DIMETHYLETHANAMINE (1:1)
Common Name English
DIPHENHYDRAMINE LAURYLSULFATE [JAN]
Common Name English
DODECYL SULFATE, DIPHENHYDRAMINE SALT
Common Name English
Diphenhydramine laurilsulfate [WHO-DD]
Common Name English
DIPHENHYDRAMINE LAURILSULFATE
WHO-DD  
Common Name English
ETHANAMINE, 2-(DIPHENYLMETHOXY)-N,N-DIMETHYL-, DODECYL SULFATE
Common Name English
ETHYLAMINE, 2-(DIPHENYLMETHOXY)-N,N-DIMETHYL-, COMPD. WITH DODECYL SULFATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60145981
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
PUBCHEM
9892949
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
EVMPD
SUB01770MIG
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
SMS_ID
100000087516
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
FDA UNII
3E2CN035LB
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
CAS
103659-13-8
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
ChEMBL
CHEMBL657
Created by admin on Sat Dec 16 04:36:39 UTC 2023 , Edited by admin on Sat Dec 16 04:36:39 UTC 2023
PRIMARY
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PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY