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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:135494 - isofezolac
Main
ChEBI Ontology
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ChEBI Name
isofezolac
ChEBI ID
CHEBI:135494
Stars
This entity has been manually annotated by a third party.
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Formula
C23H18N2O2
Net Charge
0
Average Mass
354.402
Monoisotopic Mass
354.13683
InChI
InChI=1S/C23H18N2O2/c26-
21(27)
16-
20-
22(17-
10-
4-
1-
5-
11-
17)
23(18-
12-
6-
2-
7-
13-
18)
24-
25(20)
19-
14-
8-
3-
9-
15-
19/h1-
15H,16H2,(H,26,27)
InChIKey
LZRDDINFIHUVCX-UHFFFAOYSA-N
SMILES
C(C(O)=O)C1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
ChEBI Ontology
Outgoing
isofezolac (
CHEBI:135494
)
is a
pyrazoles (
CHEBI:26410
)
isofezolac (
CHEBI:135494
)
is a
ring assembly (
CHEBI:36820
)
Synonym
Source
sofenac
DrugCentral
Manual Xref
Database
1492
DrugCentral
View more database links
Registry Number
Type
Source
50270-33-2
CAS Registry Number
DrugCentral
Last Modified
23 February 2017