DIPHENIDOL SULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C21H27NO.H2O4S
Molecular Weight	716.969
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(O)(=O)=O.OC(CCCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3.OC(CCCN4CCCCC4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChIKey=SLQWTBIXVZWYMU-UHFFFAOYSA-N

InChI=1S/2C21H27NO.H2O4S/c2*23-21(19-11-4-1-5-12-19,20-13-6-2-7-14-20)15-10-18-22-16-8-3-9-17-22;1-5(2,3)4/h2*1-2,4-7,11-14,23H,3,8-10,15-18H2;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C21H27NO
Molecular Weight	309.4452
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 `Fri Dec 15 15:35:54 UTC 2023` Edited by `admin` on `Fri Dec 15 15:35:54 UTC 2023`
Record UNII	9NWQ9G74CU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIPHENIDOL SULFATE

Common Name

English

1-PIPERIDINEBUTANOL, .ALPHA.,.ALPHA.-DIPHENYL-, SULFATE (2:1) (SALT)

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40177407

Created by admin on Fri Dec 15 15:35:54 UTC 2023 , Edited by admin on Fri Dec 15 15:35:54 UTC 2023

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PUBCHEM

71587049

Created by admin on Fri Dec 15 15:35:54 UTC 2023 , Edited by admin on Fri Dec 15 15:35:54 UTC 2023

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FDA UNII

9NWQ9G74CU

Created by admin on Fri Dec 15 15:35:54 UTC 2023 , Edited by admin on Fri Dec 15 15:35:54 UTC 2023

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CAS

22869-98-3

Created by admin on Fri Dec 15 15:35:54 UTC 2023 , Edited by admin on Fri Dec 15 15:35:54 UTC 2023

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Related Record Type Details


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DIPHENIDOL

PARENT -> SALT/SOLVATE