N-ACETYL-5-BROMOINDOLYL ACETATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H10BrNO3
Molecular Weight	296.117
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-ACETYL-5-BROMOINDOLYL ACETATE

Structure Search

SMILES

CC(=O)OC1=CN(C(C)=O)C2=C1C=C(Br)C=C2

InChI

InChIKey=XJRIDJAGAYGJCK-UHFFFAOYSA-N

InChI=1S/C12H10BrNO3/c1-7(15)14-6-12(17-8(2)16)10-5-9(13)3-4-11(10)14/h3-6H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H10BrNO3
Molecular Weight	296.117
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 `Sat Dec 16 12:33:40 GMT 2023` Edited by `admin` on `Sat Dec 16 12:33:40 GMT 2023`
Record UNII	8NPN899838
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-ACETYL-5-BROMOINDOLYL ACETATE

Systematic Name

English

1-(3-(ACETYLOXY)-5-BROMO-1H-INDOL-1-YL)ETHANONE

Systematic Name

English

1H-INDOL-3-OL, 1-ACETYL-5-BROMO-, ACETATE (ESTER)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30187292

Created by admin on Sat Dec 16 12:33:40 GMT 2023 , Edited by admin on Sat Dec 16 12:33:40 GMT 2023

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PUBCHEM

118505

Created by admin on Sat Dec 16 12:33:40 GMT 2023 , Edited by admin on Sat Dec 16 12:33:40 GMT 2023

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FDA UNII

8NPN899838

Created by admin on Sat Dec 16 12:33:40 GMT 2023 , Edited by admin on Sat Dec 16 12:33:40 GMT 2023

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ECHA (EC/EINECS)

251-584-0

Created by admin on Sat Dec 16 12:33:40 GMT 2023 , Edited by admin on Sat Dec 16 12:33:40 GMT 2023

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CAS

33588-54-4

Created by admin on Sat Dec 16 12:33:40 GMT 2023 , Edited by admin on Sat Dec 16 12:33:40 GMT 2023

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