BARBETONIUM

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H28N3O3
Molecular Weight	346.4439
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

CCC1(C(=O)NC(=O)N(CC[N+](C)(CC)CC)C1=O)C2=CC=CC=C2

InChI

InChIKey=UZNKYJAYFKROGA-UHFFFAOYSA-O

InChI=1S/C19H27N3O3/c1-5-19(15-11-9-8-10-12-15)16(23)20-18(25)21(17(19)24)13-14-22(4,6-2)7-3/h8-12H,5-7,13-14H2,1-4H3/p+1

HIDE SMILES / InChI

Molecular Formula	C19H28N3O3
Molecular Weight	346.4439
Charge	1
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:14:15 GMT 2025` Edited by `admin` on `Mon Mar 31 23:14:15 GMT 2025`
Record UNII	AX4329PH1W
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BARBETONIUM CATION

Preferred Name

English

BARBETONIUM

Common Name

English

1(2H)-PYRIMIDINEETHANAMINIUM, N,N,5-TRIETHYLTETRAHYDRO-N-METHYL-2,4,6-TRIOXO-5-PHENYL-

Systematic Name

English

AMMONIUM, DIETHYL(2-(5-ETHYLTETRAHYDRO-2,4,6-TRIOXO-5-PHENYL-1(2H)-PYRIMIDINYL)ETHYL)METHYL-

Systematic Name

English

BARBETONIUM ION

Common Name

English

Code System Code Type Description

FDA UNII

AX4329PH1W

Created by admin on Mon Mar 31 23:14:15 GMT 2025 , Edited by admin on Mon Mar 31 23:14:15 GMT 2025

PRIMARY

PUBCHEM

3083946

Created by admin on Mon Mar 31 23:14:15 GMT 2025 , Edited by admin on Mon Mar 31 23:14:15 GMT 2025

PRIMARY

CAS

698336-41-3

Created by admin on Mon Mar 31 23:14:15 GMT 2025 , Edited by admin on Mon Mar 31 23:14:15 GMT 2025

PRIMARY

Related Record Type Details


					H443GWS1FC

BARBETONIUM IODIDE

SALT/SOLVATE -> PARENT

Related Record Type Details


					AX4329PH1W

BARBETONIUM

ACTIVE MOIETY