5-[(4-Hydroxy-3-nitrobenzoyl)amino]-2-nitrobenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H9N3O8
Molecular Weight	347.2366
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-[(4-Hydroxy-3-nitrobenzoyl)amino]-2-nitrobenzoic acid

Structure Search

SMILES

OC(=O)C1=CC(NC(=O)C2=CC(=C(O)C=C2)[N+]([O-])=O)=CC=C1[N+]([O-])=O

InChI

InChIKey=KARHQWSVPLKNBE-UHFFFAOYSA-N

InChI=1S/C14H9N3O8/c18-12-4-1-7(5-11(12)17(24)25)13(19)15-8-2-3-10(16(22)23)9(6-8)14(20)21/h1-6,18H,(H,15,19)(H,20,21)

HIDE SMILES / InChI

Molecular Formula	C14H9N3O8
Molecular Weight	347.2366
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 19:46:19 GMT 2023` Edited by `admin` on `Sat Dec 16 19:46:19 GMT 2023`
Record UNII	D4N77J8HUK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-[(4-Hydroxy-3-nitrobenzoyl)amino]-2-nitrobenzoic acid

Systematic Name

English

Benzoic acid, 5-[(4-hydroxy-3-nitrobenzoyl)amino]-2-nitro-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID50234277

Created by admin on Sat Dec 16 19:46:19 GMT 2023 , Edited by admin on Sat Dec 16 19:46:19 GMT 2023

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FDA UNII

D4N77J8HUK

Created by admin on Sat Dec 16 19:46:19 GMT 2023 , Edited by admin on Sat Dec 16 19:46:19 GMT 2023

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CAS

85136-66-9

Created by admin on Sat Dec 16 19:46:19 GMT 2023 , Edited by admin on Sat Dec 16 19:46:19 GMT 2023

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PUBCHEM

3020417

Created by admin on Sat Dec 16 19:46:19 GMT 2023 , Edited by admin on Sat Dec 16 19:46:19 GMT 2023

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ECHA (EC/EINECS)

285-791-2

Created by admin on Sat Dec 16 19:46:19 GMT 2023 , Edited by admin on Sat Dec 16 19:46:19 GMT 2023

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