2-ACETYL-5-NITROPYRROLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H6N2O3
Molecular Weight	154.1234
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ACETYL-5-NITROPYRROLE

Structure Search

SMILES

CC(=O)C1=CC=C(N1)[N+]([O-])=O

InChI

InChIKey=LIJJWPMRFYFJFR-UHFFFAOYSA-N

InChI=1S/C6H6N2O3/c1-4(9)5-2-3-6(7-5)8(10)11/h2-3,7H,1H3

HIDE SMILES / InChI

Molecular Formula	C6H6N2O3
Molecular Weight	154.1234
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 `Fri Dec 15 16:39:55 GMT 2023` Edited by `admin` on `Fri Dec 15 16:39:55 GMT 2023`
Record UNII	U66Y4C4WEY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-ACETYL-5-NITROPYRROLE

Common Name

English

KETONE, METHYL (5-NITRO-2-PYRROLYL)

Systematic Name

English

PYRROLE, 2-ACETYL-5-NITRO-

Common Name

English

ACETYL-5-NITROPYRROLE, 2-

Systematic Name

English

NSC-87231

Code

English

Code System Code Type Description

CAS

32116-25-9

Created by admin on Fri Dec 15 16:39:55 GMT 2023 , Edited by admin on Fri Dec 15 16:39:55 GMT 2023

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NSC

87231

Created by admin on Fri Dec 15 16:39:55 GMT 2023 , Edited by admin on Fri Dec 15 16:39:55 GMT 2023

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EPA CompTox

DTXSID80185905

Created by admin on Fri Dec 15 16:39:55 GMT 2023 , Edited by admin on Fri Dec 15 16:39:55 GMT 2023

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PUBCHEM

36066

Created by admin on Fri Dec 15 16:39:55 GMT 2023 , Edited by admin on Fri Dec 15 16:39:55 GMT 2023

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FDA UNII

U66Y4C4WEY

Created by admin on Fri Dec 15 16:39:55 GMT 2023 , Edited by admin on Fri Dec 15 16:39:55 GMT 2023

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