3-((2-HYDROXYETHYL)CARBAMOYL)-5-NITROBENZOIC ACID

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10N2O6
Molecular Weight	254.1962
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-((2-HYDROXYETHYL)CARBAMOYL)-5-NITROBENZOIC ACID

Structure Search

SMILES

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

InChI

InChIKey=CPXQPGXUDGWVSK-UHFFFAOYSA-N

InChI=1S/C10H10N2O6/c13-2-1-11-9(14)6-3-7(10(15)16)5-8(4-6)12(17)18/h3-5,13H,1-2H2,(H,11,14)(H,15,16)

HIDE SMILES / InChI

Molecular Formula	C10H10N2O6
Molecular Weight	254.1962
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 `Tue Apr 01 17:46:50 GMT 2025` Edited by `admin` on `Tue Apr 01 17:46:50 GMT 2025`
Record UNII	8KN7288AQ4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-((2-HYDROXYETHYL)CARBAMOYL)-5-NITROBENZOIC ACID

Common Name

English

3-(((2-HYDROXYETHYL)AMINO)CARBONYL)-5-NITROBENZOIC ACID

Preferred Name

English

BENZOIC ACID, 3-(((2-HYDROXYETHYL)AMINO)CARBONYL)-5-NITRO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

89873

Created by admin on Tue Apr 01 17:46:50 GMT 2025 , Edited by admin on Tue Apr 01 17:46:50 GMT 2025

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EPA CompTox

DTXSID70177410

Created by admin on Tue Apr 01 17:46:50 GMT 2025 , Edited by admin on Tue Apr 01 17:46:50 GMT 2025

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FDA UNII

8KN7288AQ4

Created by admin on Tue Apr 01 17:46:50 GMT 2025 , Edited by admin on Tue Apr 01 17:46:50 GMT 2025

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CAS

22871-56-3

Created by admin on Tue Apr 01 17:46:50 GMT 2025 , Edited by admin on Tue Apr 01 17:46:50 GMT 2025

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ECHA (EC/EINECS)

245-274-4

Created by admin on Tue Apr 01 17:46:50 GMT 2025 , Edited by admin on Tue Apr 01 17:46:50 GMT 2025

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