Isoxafenacil

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H16ClF4N3O5
Molecular Weight	477.794
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOC(=O)C1(C)CC(=NO1)C2=CC(N3C(=O)C=C(N(C)C3=O)C(F)(F)F)=C(F)C=C2Cl

InChI

InChIKey=ZFQQLFKHTMIGJX-UHFFFAOYSA-N

InChI=1S/C19H16ClF4N3O5/c1-4-31-16(29)18(2)8-12(25-32-18)9-5-13(11(21)6-10(9)20)27-15(28)7-14(19(22,23)24)26(3)17(27)30/h5-7H,4,8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C19H16ClF4N3O5
Molecular Weight	477.794
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:09:36 GMT 2025` Edited by `admin` on `Wed Apr 02 21:09:36 GMT 2025`
Record UNII	XDW5XZ5MRP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isoxafenacil

Official Name

English

Isoxafenacil [ISO]

Preferred Name

English

Ethyl 3-[2-chloro-5-[3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-4-fluorophenyl]-4,5-dihydro-5-methyl-5-isoxazolecarboxylate

Systematic Name

English

3-(2-Chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-trifluoromethyl-3,6-dihydropyrimidin-1(2H)-yl)phenyl)-5-methyl-4,5-dihydroisoxazole-5-carboxylic acid ethyl ester

Systematic Name

English

5-Isoxazolecarboxylic acid, 3-[2-chloro-5-[3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-4-fluorophenyl]-4,5-dihydro-5-methyl-, ethyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

146323887

Created by admin on Wed Apr 02 21:09:36 GMT 2025 , Edited by admin on Wed Apr 02 21:09:36 GMT 2025

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FDA UNII

XDW5XZ5MRP

Created by admin on Wed Apr 02 21:09:36 GMT 2025 , Edited by admin on Wed Apr 02 21:09:36 GMT 2025

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CAS

1949837-17-5

Created by admin on Wed Apr 02 21:09:36 GMT 2025 , Edited by admin on Wed Apr 02 21:09:36 GMT 2025

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