ACETOCHLOR ETHANESULFONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H21NO5S
Molecular Weight	315.385
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACETOCHLOR ETHANESULFONIC ACID

Structure Search

SMILES

CCOCN(C(=O)CS(O)(=O)=O)C1=C(C)C=CC=C1CC

InChI

InChIKey=HXAIQOCRALNGKB-UHFFFAOYSA-N

InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)

HIDE SMILES / InChI

Molecular Formula	C14H21NO5S
Molecular Weight	315.385
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 22:52:10 GMT 2025` Edited by `admin` on `Mon Mar 31 22:52:10 GMT 2025`
Record UNII	R7MV6SGC16
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACETOCHLOR ESA

Preferred Name

English

ACETOCHLOR ETHANESULFONIC ACID

Common Name

English

ETHANESULFONIC ACID, 2-((ETHOXYMETHYL)(2-ETHYL-6-METHYLPHENYL)AMINO)-2-OXO-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID6037483

Created by admin on Mon Mar 31 22:52:10 GMT 2025 , Edited by admin on Mon Mar 31 22:52:10 GMT 2025

PRIMARY

CHEBI

83452

Created by admin on Mon Mar 31 22:52:10 GMT 2025 , Edited by admin on Mon Mar 31 22:52:10 GMT 2025

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PUBCHEM

6426848

Created by admin on Mon Mar 31 22:52:10 GMT 2025 , Edited by admin on Mon Mar 31 22:52:10 GMT 2025

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FDA UNII

R7MV6SGC16

Created by admin on Mon Mar 31 22:52:10 GMT 2025 , Edited by admin on Mon Mar 31 22:52:10 GMT 2025

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CAS

187022-11-3

Created by admin on Mon Mar 31 22:52:10 GMT 2025 , Edited by admin on Mon Mar 31 22:52:10 GMT 2025

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