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English
Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
452.1947366159999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₂₈N₂O₆
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canonical SMILES
CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3)(C(=O)OCC)NC(=O)C
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Identifiers
InChI
InChI=1S/C25H28N2O6/c1-4-31-23(29)25(27-17(3)28,24(30)32-5-2)14-19-15-26-22-12-11-20(13-21(19)22)33-16-18-9-7-6-8-10-18/h6-13,15,26H,4-5,14,16H2,1-3H3,(H,27,28)
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InChIKey
AIHVUEYJDRTUHZ-UHFFFAOYSA-N
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CAS Registry Number
50469-23-3
1 reference
InChIKey
AIHVUEYJDRTUHZ-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=50469-23-3
PubChem CID
95105
1 reference
matched by identifier from
InChIKey
InChIKey
AIHVUEYJDRTUHZ-UHFFFAOYSA-N
UniChem compound ID
8578502
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40198495
1 reference
matched by identifier from
InChIKey
InChIKey
AIHVUEYJDRTUHZ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70120986
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NSC number
17820
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