U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C21H22ClNO4
Molecular Weight 387.857
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DIMETHOMORPH, (Z)-

SMILES

COC1=CC=C(C=C1OC)C(=C/C(=O)N2CCOCC2)\C3=CC=C(Cl)C=C3

InChI

InChIKey=QNBTYORWCCMPQP-JXAWBTAJSA-N
InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14-

HIDE SMILES / InChI
Molecular Formula C21H22ClNO4
Molecular Weight 387.857
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Widely used pesticides with previously unknown endocrine activity revealed as in vitro antiandrogens.
2011 Jun
Patents

Patents

JP2000001408A
2
JP2000053506A
2
JP2000264802A
3
JP2001072510A
3
JP2002193716A
2
JP2006028162A
2
JP2006143705A
5
JP2008509189A
188
JP2010006828A
3
JP2010524483A
52
JP2011201851A
8
JP2011509959A
61
JP2011509971A
151
JP2011511032A
40
JP2011511033A
33
JP2011527306A
55
JP2012500824A
79
JP4711975B2
14
JP4832524B2
6
JPH01207203A
2
JPH04257502A
3
JPH06247810A
3
JPH06329505A
4
JPH07101813A
2
JPH07196411A
2
JPH0789812A
5
JPH09291004A
3
JPH09291005A
2
JPH11302109A
2
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:32:15 GMT 2023
Edited
by admin
on Fri Dec 15 17:32:15 GMT 2023
Record UNII
37V7980RBV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMETHOMORPH, (Z)-
Common Name English
Z-DIMETHOMORPH
Common Name English
2-PROPEN-1-ONE, 3-(4-CHLOROPHENYL)-3-(3,4-DIMETHOXYPHENYL)-1-(4-MORPHOLINYL)-, (2Z)-
Systematic Name English
MORPHOLINE, 4-(3-(4-CHLOROPHENYL)-3-(3,4-DIMETHOXYPHENYL)-1-OXO-2-PROPENYL)-, (Z)-
Common Name English
MORPHOLINE, 4-((2Z)-3-(4-CHLOROPHENYL)-3-(3,4-DIMETHOXYPHENYL)-1-OXO-2-PROPENYL)-
Systematic Name English
DIMETHOMORPH Z
Common Name English
(Z)-DIMETHOMORPH
Common Name English
Code System Code Type Description
CAS
113210-98-3
Created by admin on Fri Dec 15 17:32:15 GMT 2023 , Edited by admin on Fri Dec 15 17:32:15 GMT 2023
PRIMARY
CHEBI
83427
Created by admin on Fri Dec 15 17:32:15 GMT 2023 , Edited by admin on Fri Dec 15 17:32:15 GMT 2023
PRIMARY
PUBCHEM
5463781
Created by admin on Fri Dec 15 17:32:15 GMT 2023 , Edited by admin on Fri Dec 15 17:32:15 GMT 2023
PRIMARY
FDA UNII
37V7980RBV
Created by admin on Fri Dec 15 17:32:15 GMT 2023 , Edited by admin on Fri Dec 15 17:32:15 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966