2-(5-nitro-1,3-dioxoisoindol-2-yl)ethyl-triphenylphosphanium bromide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H22N2O4P.Br
Molecular Weight	561.363
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(5-nitro-1,3-dioxoisoindol-2-yl)ethyl-triphenylphosphanium bromide

Structure Search

SMILES

[Br-].[O-][N+](=O)C1=CC=C2C(=O)N(CC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C2=C1

InChI

InChIKey=ZINYTDGHILYKDD-UHFFFAOYSA-M

InChI=1S/C28H22N2O4P.BrH/c31-27-25-17-16-21(30(33)34)20-26(25)28(32)29(27)18-19-35(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24;/h1-17,20H,18-19H2;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	Br
Molecular Weight	79.904
Charge	-1
Count

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

Molecular Formula	C28H22N2O4P
Molecular Weight	481.459
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 16:47:00 GMT 2025` Edited by `admin` on `Wed Apr 02 16:47:00 GMT 2025`
Record UNII	Y4ZR3H365Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-270902

Preferred Name

English

2-(5-nitro-1,3-dioxoisoindol-2-yl)ethyl-triphenylphosphanium bromide

Systematic Name

English

Phosphonium, [2-(1,3-dihydro-5-nitro-1,3-dioxo-2H-isoindol-2-yl)ethyl]triphenyl-, bromide

Systematic Name

English

Phosphonium, [2-(1,3-dihydro-5-nitro-1,3-dioxo-2H-isoindol-2-yl)ethyl]triphenyl-, bromide (1:1)

Common Name

English

Code System Code Type Description

NSC

270902