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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22ClNO2
Molecular Weight 283.794
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-METOLACHLOR

SMILES

CCC1=CC=CC(C)=C1N([C@@H](C)COC)C(=O)CCl

InChI

InChIKey=WVQBLGZPHOPPFO-LBPRGKRZSA-N
InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H22ClNO2
Molecular Weight 283.794
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006-11
Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens.
2001-03
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 20:33:03 GMT 2025
Edited
by admin
on Mon Mar 31 20:33:03 GMT 2025
Record UNII
1O4NMK7I6H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METOLACHLOR S-FORM
MI  
Preferred Name English
S-METOLACHLOR
ISO  
Common Name English
DUAL II MAGNUM
Brand Name English
S-METHOLACHLOR
Common Name English
.ALPHA.-METOLACHLOR
Common Name English
(S)-METOLACHOR
Common Name English
METOLACHLOR S-FORM [MI]
Common Name English
S-METOLACHLOR [ISO]
Common Name English
METOLACHLOR, (S)-
Common Name English
ACETAMIDE, 2-CHLORO-N-(2-ETHYL-6-METHYLPHENYL)-N-((1S)-2-METHOXY-1-METHYLETHYL)-
Systematic Name English
BRAWL
Brand Name English
DUAL GOLD
Brand Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 108800
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
Code System Code Type Description
ALANWOOD
S-metolachlor
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY
CAS
87392-12-9
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY
PUBCHEM
11140605
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID6032431
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY
MERCK INDEX
m7493
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY Merck Index
FDA UNII
1O4NMK7I6H
Created by admin on Mon Mar 31 20:33:03 GMT 2025 , Edited by admin on Mon Mar 31 20:33:03 GMT 2025
PRIMARY