3-[[3-(3-Chloropropoxy)-4-methoxyphenyl]amino]-2-cyano-N-(2,4-dichloro-5-methoxyphenyl)-2-propenamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H20Cl3N3O4
Molecular Weight	484.76
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-[[3-(3-Chloropropoxy)-4-methoxyphenyl]amino]-2-cyano-N-(2,4-dichloro-5-methoxyphenyl)-2-propenamide

Structure Search

SMILES

COC1=C(Cl)C=C(Cl)C(NC(=O)C(=C\NC2=CC(OCCCCl)=C(OC)C=C2)\C#N)=C1

InChI

InChIKey=XYQKQBFPQQNWCY-OUKQBFOZSA-N

InChI=1S/C21H20Cl3N3O4/c1-29-18-5-4-14(8-20(18)31-7-3-6-22)26-12-13(11-25)21(28)27-17-10-19(30-2)16(24)9-15(17)23/h4-5,8-10,12,26H,3,6-7H2,1-2H3,(H,27,28)/b13-12+

HIDE SMILES / InChI

Molecular Formula	C21H20Cl3N3O4
Molecular Weight	484.76
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:31:59 GMT 2023` Edited by `admin` on `Sat Dec 16 19:31:59 GMT 2023`
Record UNII	E7JK3W6XMC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-[[3-(3-Chloropropoxy)-4-methoxyphenyl]amino]-2-cyano-N-(2,4-dichloro-5-methoxyphenyl)-2-propenamide

Systematic Name

English

3-[[3-(3-Chloropropoxy)-4-methoxyphenyl]amino]-N-(2,4-dichloro-5-methoxyphenyl)-2-cyano-2-propenamide

Systematic Name

English

2-Propenamide, 3-[[3-(3-chloropropoxy)-4-methoxyphenyl]amino]-2-cyano-N-(2,4-dichloro-5-methoxyphenyl)-

Systematic Name

English

Code System Code Type Description

CAS

846023-34-5

Created by admin on Sat Dec 16 19:31:59 GMT 2023 , Edited by admin on Sat Dec 16 19:31:59 GMT 2023

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EPA CompTox

DTXSID601113216

Created by admin on Sat Dec 16 19:31:59 GMT 2023 , Edited by admin on Sat Dec 16 19:31:59 GMT 2023

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FDA UNII

E7JK3W6XMC

Created by admin on Sat Dec 16 19:31:59 GMT 2023 , Edited by admin on Sat Dec 16 19:31:59 GMT 2023

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PUBCHEM

87779835

Created by admin on Sat Dec 16 19:31:59 GMT 2023 , Edited by admin on Sat Dec 16 19:31:59 GMT 2023

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