BUTALLYLONAL SODIUM

Details

Stereochemistry	RACEMIC
Molecular Formula	C11H14BrN2O3.Na
Molecular Weight	325.134
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CCC(C)C1(CC(Br)=C)C(=O)NC(=O)[N-]C1=O

InChI

InChIKey=WITMQGCBPSZFPH-UHFFFAOYSA-M

InChI=1S/C11H15BrN2O3.Na/c1-4-6(2)11(5-7(3)12)8(15)13-10(17)14-9(11)16;/h6H,3-5H2,1-2H3,(H2,13,14,15,16,17);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	C11H15BrN2O3
Molecular Weight	303.152
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Approval Year

PubMed

Title	Date	PubMed
Butallyl-onal 1,4-dioxane hemisolvate.	2010 Sep 30	21587656

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:31:38 GMT 2023` Edited by `admin` on `Fri Dec 15 20:31:38 GMT 2023`
Record UNII	0T88779JJY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTALLYLONAL SODIUM

Common Name

English

5-(2-BROMOALLYL)-5-SEC-BUTYLBARBITURATE SODIUM

Systematic Name

English

SODIUM 5-(2-BROMOALLYL)-5-SEC-BUTYLBARBITURATE

Systematic Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(2-BROMO-2-PROPEN-1-YL)-5-(1-METHYLPROPYL)-, SODIUM SALT (1:1)

Common Name

English

BARBITURIC ACID, 5-(2-BROMOALLYL)-5-SEC-BUTYL-, SODIUM SALT

Common Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(2-BROMO-2-PROPENYL)-5-(1-METHYLPROPYL)-, MONOSODIUM SALT

Common Name

English

PERNOSTON SODIUM

Brand Name

English

BUTALLYLONAL SODIUM SALT [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

23691023