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(Q82228067)
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MLS002638610
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
353.12632270800003
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₁₉NO₅
0 references
canonical SMILES
CCOC(=O)/C(=C\OC(=O)c1ccccc1)NC(=O)Cc1ccccc1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CCOC(=O)/C(=C\OC(=O)C1=CC=CC=C1)/NC(=O)CC2=CC=CC=C2
0 references
Identifiers
InChI
InChI=1S/C20H19NO5/c1-2-25-20(24)17(14-26-19(23)16-11-7-4-8-12-16)21-18(22)13-15-9-5-3-6-10-15/h3-12,14H,2,13H2,1H3,(H,21,22)/b17-14+
0 references
InChIKey
JFGDJEPGHSCLDA-SAPNQHFASA-N
0 references
CAS Registry Number
7251-81-2
0 references
PubChem CID
5354770
0 references
UniChem compound ID
17179804
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20417853
0 references
DSSTOX compound identifier
DTXCID90368702
0 references
NSC number
18734
0 references
408930
0 references
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