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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:63927 - cinidon ethyl
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ChEBI Name
cinidon ethyl
ChEBI ID
CHEBI:63927
Definition
A carboxylic ester and organochlorine compound that is the ethyl ester of cinidon.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C19H17Cl2NO4
Net Charge
0
Average Mass
394.24900
Monoisotopic Mass
393.05346
InChI
InChI=1S/C19H17Cl2NO4/c1-
2-
26-
19(25)
16(21)
10-
11-
9-
12(7-
8-
15(11)
20)
22-
17(23)
13-
5-
3-
4-
6-
14(13)
18(22)
24/h7-
10H,2-
6H2,1H3/b16-
10-
InChIKey
NNKKTZOEKDFTBU-YBEGLDIGSA-N
SMILES
CCOC(=O)C(\Cl)=C\c1cc(ccc1Cl)N1C(=O)C2=C(CCCC2)C1=O
Roles Classification
Application
(s):
herbicide
A substance used to destroy plant pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cinidon ethyl (
CHEBI:63927
)
has role
herbicide (
CHEBI:24527
)
cinidon ethyl (
CHEBI:63927
)
is a
ethyl ester (
CHEBI:23990
)
cinidon ethyl (
CHEBI:63927
)
is a
isoindoles (
CHEBI:24897
)
cinidon ethyl (
CHEBI:63927
)
is a
monochlorobenzenes (
CHEBI:83403
)
IUPAC Name
ethyl (2
Z
)-
2-
chloro-
3-
[2-
chloro-
5-
(1,3-
dioxo-
1,3,4,5,6,7-
hexahydro-
2
H
-
isoindol-
2-
yl)phenyl]prop-
2-
enoate
Synonyms
Sources
cinidon-ethyl
ChEBI
ethyl (2
Z
)-
2-
chloro-
3-
[2-
chloro-
5-
(1,3-
dioxo-
1,3,4,5,6,7-
hexahydro-
2
H
-
isoindol-
2-
yl)phenyl]acrylate
IUPAC
Manual Xrefs
Databases
162
PPDB
DE3603789
Patent
US5062884
Patent
View more database links
Registry Numbers
Types
Sources
132057-06-8
CAS Registry Number
ChemIDplus
142891-20-1
CAS Registry Number
ChemIDplus
8446817
Reaxys Registry Number
Reaxys
Last Modified
02 March 2015