CH-0076989 CATION

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H22BrN2O2
Molecular Weight	450.348
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

BrC1=[N+](CCCC2=CC=CC=C2)C=CC(NC(=O)CC3=CC=CC4=C3C=CO4)=C1

InChI

InChIKey=HLARTUPABRWNJP-UHFFFAOYSA-O

InChI=1S/C24H21BrN2O2/c25-23-17-20(11-14-27(23)13-5-8-18-6-2-1-3-7-18)26-24(28)16-19-9-4-10-22-21(19)12-15-29-22/h1-4,6-7,9-12,14-15,17H,5,8,13,16H2/p+1

HIDE SMILES / InChI

Molecular Formula	C24H21BrN2O2
Molecular Weight	449.34
Charge	0
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 `Mon Mar 31 21:51:11 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:11 GMT 2025`
Record UNII	L38YA3L52Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CH-0076989 CATION

Common Name

English

CH-0076989 ION

Preferred Name

English

PYRIDINIUM, 4-((2-(4-BENZOFURANYL)ACETYL)AMINO)-2-BROMO-1-(3-PHENYLPROPYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

L38YA3L52Z

Created by admin on Mon Mar 31 21:51:11 GMT 2025 , Edited by admin on Mon Mar 31 21:51:11 GMT 2025

PRIMARY

CAS

954499-24-2

Created by admin on Mon Mar 31 21:51:11 GMT 2025 , Edited by admin on Mon Mar 31 21:51:11 GMT 2025

PRIMARY

PUBCHEM

44560291

Created by admin on Mon Mar 31 21:51:11 GMT 2025 , Edited by admin on Mon Mar 31 21:51:11 GMT 2025

PRIMARY

Related Record Type Details


					L38YA3L52Z

CH-0076989 CATION

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