2-(4-(Dimethylamino)styryl)-1-methylpyridin-1-ium tosylate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H19N2.C7H7O3S
Molecular Weight	410.529
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2-(4-(Dimethylamino)styryl)-1-methylpyridin-1-ium tosylate

Structure Search

SMILES

CC1=CC=C(C=C1)S([O-])(=O)=O.CN(C)C2=CC=C(\C=C\C3=[N+](C)C=CC=C3)C=C2

InChI

InChIKey=PYYQQLHMGIKUEM-UHFFFAOYSA-M

InChI=1S/C16H19N2.C7H8O3S/c1-17(2)15-10-7-14(8-11-15)9-12-16-6-4-5-13-18(16)3;1-6-2-4-7(5-3-6)11(8,9)10/h4-13H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C7H7O3S
Molecular Weight	171.194
Charge	-1
Count

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

Molecular Formula	C16H19N2
Molecular Weight	239.3355
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:19:39 GMT 2023` Edited by `admin` on `Sat Dec 16 12:19:39 GMT 2023`
Record UNII	KX58KD5H7K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(4-(Dimethylamino)styryl)-1-methylpyridin-1-ium tosylate

Systematic Name

English

Pyridinium, 2-[(1E)-2-[4-(dimethylamino)phenyl]ethenyl]-1-methyl-, 4-methylbenzenesulfonate (1:1)

Systematic Name

English

PYRIDINIUM, 2-(2-(4-(DIMETHYLAMINO)PHENYL)ETHENYL)-1-METHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID (1:1)

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

251-330-9

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

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PUBCHEM

118373

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

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CAS

1246473-83-5

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

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EPA CompTox

DTXSID3067738

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

PRIMARY

CAS

33006-24-5

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

KX58KD5H7K

Created by admin on Sat Dec 16 12:19:39 GMT 2023 , Edited by admin on Sat Dec 16 12:19:39 GMT 2023

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Related Record Type Details


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2-(4-(Dimethylamino)styryl)-1-methylpyridin-1-ium

PARENT -> SALT/SOLVATE

Amount: