N,N',N'-TRIMETHYL-N-(2-HYDROXY-5-IODO-3-METHYLBENZYL)-1,3-PROPANEDIAMINE DIHYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H23IN2O.2ClH
Molecular Weight	435.172
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N',N'-TRIMETHYL-N-(2-HYDROXY-5-IODO-3-METHYLBENZYL)-1,3-PROPANEDIAMINE DIHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.CN(C)CCCN(C)CC1=C(O)C(C)=CC(I)=C1

InChI

InChIKey=SXPLHSWEPJPKDJ-UHFFFAOYSA-N

InChI=1S/C14H23IN2O.2ClH/c1-11-8-13(15)9-12(14(11)18)10-17(4)7-5-6-16(2)3;;/h8-9,18H,5-7,10H2,1-4H3;2*1H

HIDE SMILES / InChI

Molecular Formula	C14H23IN2O
Molecular Weight	362.2497
Charge	0
Count

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

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 `Fri Dec 15 15:47:44 GMT 2023` Edited by `admin` on `Fri Dec 15 15:47:44 GMT 2023`
Record UNII	2ZCU8ZI7Z2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N',N'-TRIMETHYL-N-(2-HYDROXY-5-IODO-3-METHYLBENZYL)-1,3-PROPANEDIAMINE DIHYDROCHLORIDE

Systematic Name

English

N,N,N'-TRIMETHYL-N'-(2-HYDROXY-3-METHYL-5-IODO-BENZYL)-1,3-PROPANDIAMINE DIHYDROCHLORIDE

Systematic Name

English

PHENOL, 2-(((3-(DIMETHYLAMINO)PROPYL)METHYLAMINO)METHYL)-4-IODO-6-METHYL-, HYDROCHLORIDE (1:2)

Systematic Name

English

Code System Code Type Description

FDA UNII

2ZCU8ZI7Z2

Created by admin on Fri Dec 15 15:47:44 GMT 2023 , Edited by admin on Fri Dec 15 15:47:44 GMT 2023

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EPA CompTox

DTXSID80426067

Created by admin on Fri Dec 15 15:47:44 GMT 2023 , Edited by admin on Fri Dec 15 15:47:44 GMT 2023

PRIMARY

PUBCHEM

2737336

Created by admin on Fri Dec 15 15:47:44 GMT 2023 , Edited by admin on Fri Dec 15 15:47:44 GMT 2023

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CAS

89815-43-0

Created by admin on Fri Dec 15 15:47:44 GMT 2023 , Edited by admin on Fri Dec 15 15:47:44 GMT 2023

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