DIPHENHYDRAMINE METILSULFATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H21NO.CH4O4S
Molecular Weight	367.46
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIPHENHYDRAMINE METILSULFATE

Structure Search

SMILES

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

InChI

InChIKey=IAEUDFPHDMPZNA-UHFFFAOYSA-N

InChI=1S/C17H21NO.CH4O4S/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-5-6(2,3)4/h3-12,17H,13-14H2,1-2H3;1H3,(H,2,3,4)

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	CH4O4S
Molecular Weight	112.105
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 `Mon Mar 31 21:58:57 GMT 2025` Edited by `admin` on `Mon Mar 31 21:58:57 GMT 2025`
Record UNII	7W6W25C62W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIPHENHYDRAMINE METHYLSULFATE

Preferred Name

English

DIPHENHYDRAMINE METILSULFATE

Common Name

English

Diphenhydramine metilsulfate [WHO-DD]

Common Name

English

SULFURIC ACID, MONOMETHYL ESTER, COMPD. WITH 2-(DIPHENYLMETHOXY)-N,N-DIMETHYLETHANAMINE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

7W6W25C62W

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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EPA CompTox

DTXSID40992334

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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CAS

71720-61-1

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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EVMPD

SUB01772MIG

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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SMS_ID

100000087517

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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PUBCHEM

3018245

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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ECHA (EC/EINECS)

275-910-6

Created by admin on Mon Mar 31 21:58:57 GMT 2025 , Edited by admin on Mon Mar 31 21:58:57 GMT 2025

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