PENTRYL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H6N6O11
Molecular Weight	362.1668
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTRYL

Structure Search

SMILES

[O-][N+](=O)OCCN(C1=C(C=C(C=C1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=UNMSQGCYXOMOAC-UHFFFAOYSA-N

InChI=1S/C8H6N6O11/c15-10(16)5-3-6(11(17)18)8(7(4-5)12(19)20)9(13(21)22)1-2-25-14(23)24/h3-4H,1-2H2

HIDE SMILES / InChI

Molecular Formula	C8H6N6O11
Molecular Weight	362.1668
Charge	0
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 `Mon Mar 31 22:51:47 GMT 2025` Edited by `admin` on `Mon Mar 31 22:51:47 GMT 2025`
Record UNII	EF9BEM54XJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTRYL

Common Name

English

PENTRYL [MI]

Preferred Name

English

ETHANOL, 2-(NITRO(2,4,6-TRINITROPHENYL)AMINO)-, 1-NITRATE

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

Draft:Pentryl

Created by admin on Mon Mar 31 22:51:47 GMT 2025 , Edited by admin on Mon Mar 31 22:51:47 GMT 2025

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PUBCHEM

617736

Created by admin on Mon Mar 31 22:51:47 GMT 2025 , Edited by admin on Mon Mar 31 22:51:47 GMT 2025

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FDA UNII

EF9BEM54XJ

Created by admin on Mon Mar 31 22:51:47 GMT 2025 , Edited by admin on Mon Mar 31 22:51:47 GMT 2025

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CAS

4481-55-4

Created by admin on Mon Mar 31 22:51:47 GMT 2025 , Edited by admin on Mon Mar 31 22:51:47 GMT 2025

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MERCK INDEX

m8522

Created by admin on Mon Mar 31 22:51:47 GMT 2025 , Edited by admin on Mon Mar 31 22:51:47 GMT 2025

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Merck Index