WAY127039-A-1 sodium salt

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H9BrNO4.Na
Molecular Weight	370.13
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].NC1=C(C=CC=C1C(=O)C2=CC=C(Br)C=C2)C(=O)C([O-])=O

InChI

InChIKey=JBHOQRLXZXDGOO-UHFFFAOYSA-M

InChI=1S/C15H10BrNO4.Na/c16-9-6-4-8(5-7-9)13(18)10-2-1-3-11(12(10)17)14(19)15(20)21;/h1-7H,17H2,(H,20,21);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	C15H9BrNO4
Molecular Weight	347.14
Charge	-1
Count

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

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
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 `Wed Apr 02 17:54:44 GMT 2025` Edited by `admin` on `Wed Apr 02 17:54:44 GMT 2025`
Record UNII	TQD89JU7C9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

WAY127039-A-1 sodium salt

Common Name

English

WAY-127039-A-1 sodium salt

Preferred Name

English

sodium 2-(2-amino-3-(4-bromobenzoyl)phenyl)-2-oxoacetate

Systematic Name

English

Benzeneacetic acid, 2-amino-3-(4-bromobenzoyl)-?-oxo-, sodium salt (1:1)

Systematic Name

English

Code System Code Type Description

CAS

1391052-54-2

Created by admin on Wed Apr 02 17:54:44 GMT 2025 , Edited by admin on Wed Apr 02 17:54:44 GMT 2025

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PUBCHEM

71752991

Created by admin on Wed Apr 02 17:54:44 GMT 2025 , Edited by admin on Wed Apr 02 17:54:44 GMT 2025

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FDA UNII

TQD89JU7C9

Created by admin on Wed Apr 02 17:54:44 GMT 2025 , Edited by admin on Wed Apr 02 17:54:44 GMT 2025

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WAY-127039-A-1

PARENT -> SALT/SOLVATE

Amount: