METHINDETHYRIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H31N3.2Cl
Molecular Weight	408.408
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Cl-].[Cl-].CN1C=C(CCC2=CC=[N+](CCC[N+](C)(C)C)C=C2)C3=C1C=CC=C3

InChI

InChIKey=OCGHTXCFNFYSEY-UHFFFAOYSA-L

InChI=1S/C22H31N3.2ClH/c1-23-18-20(21-8-5-6-9-22(21)23)11-10-19-12-15-24(16-13-19)14-7-17-25(2,3)4;;/h5-6,8-9,12-13,15-16,18H,7,10-11,14,17H2,1-4H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	C22H31N3
Molecular Weight	337.5016
Charge	2
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
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 `Mon Mar 31 17:37:01 GMT 2025` Edited by `admin` on `Mon Mar 31 17:37:01 GMT 2025`
Record UNII	N4JMG9AVTJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IN-391

Preferred Name

English

METHINDETHYRIUM

Common Name

English

NSC-19481

Code

English

PYRIDINIUM, 4-(2-(1-METHYL-1H-INDOL-3-YL)ETHYL)-1-(3-(TRIMETHYLAMMONIO)PROPYL)-, CHLORIDE (1:2)

Systematic Name

English

PYRIDINIUM, 4-(2-(1-METHYL-1H-INDOL-3-YL)ETHYL)-1-(3-(TRIMETHYLAMMONIO)PROPYL)-, DICHLORIDE

Systematic Name

English

ISOTENSEN

Common Name

English

Code System Code Type Description

NSC

19481