2-Benzylisoquinolin-2-ium iodide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H14N.I
Molecular Weight	347.1935
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Benzylisoquinolin-2-ium iodide

Structure Search

SMILES

[I-].C(C1=CC=CC=C1)[N+]2=CC=C3C=CC=CC3=C2

InChI

InChIKey=KXFBYWMFCWFEFX-UHFFFAOYSA-M

InChI=1S/C16H14N.HI/c1-2-6-14(7-3-1)12-17-11-10-15-8-4-5-9-16(15)13-17;/h1-11,13H,12H2;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C16H14N
Molecular Weight	220.2891
Charge	1
Count

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

Molecular Formula	I
Molecular Weight	126.90447
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 18:49:06 GMT 2025` Edited by `admin` on `Wed Apr 02 18:49:06 GMT 2025`
Record UNII	FG9DQX3DQA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isoquinolinium, 2-(phenylmethyl)-, iodide

Preferred Name

English

2-Benzylisoquinolin-2-ium iodide

Systematic Name

English

Isoquinolinium, 2-(phenylmethyl)-, iodide (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

24186355

Created by admin on Wed Apr 02 18:49:06 GMT 2025 , Edited by admin on Wed Apr 02 18:49:06 GMT 2025

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EPA CompTox

DTXSID20637216

Created by admin on Wed Apr 02 18:49:06 GMT 2025 , Edited by admin on Wed Apr 02 18:49:06 GMT 2025

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FDA UNII

FG9DQX3DQA

Created by admin on Wed Apr 02 18:49:06 GMT 2025 , Edited by admin on Wed Apr 02 18:49:06 GMT 2025

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CAS

15787-39-0

Created by admin on Wed Apr 02 18:49:06 GMT 2025 , Edited by admin on Wed Apr 02 18:49:06 GMT 2025

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Related Record Type Details


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2-Benzylisoquinolinium

PARENT -> SALT/SOLVATE

Amount: