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(Q82026901)
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English
MLS002693358
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
217.085126592
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₁N₃O₂
0 references
canonical SMILES
CC1=CC=C(C=C1)NC2=C(N=CNC2=O)O
0 references
Identifiers
InChI
InChI=1S/C11H11N3O2/c1-7-2-4-8(5-3-7)14-9-10(15)12-6-13-11(9)16/h2-6,14H,1H3,(H2,12,13,15,16)
0 references
InChIKey
VBVXISQEKXSPKD-UHFFFAOYSA-N
0 references
CAS Registry Number
6972-22-1
0 references
PubChem CID
247426
1 reference
matched by identifier from
InChIKey
InChIKey
VBVXISQEKXSPKD-UHFFFAOYSA-N
UniChem compound ID
27231509
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60289556
1 reference
matched by identifier from
InChIKey
InChIKey
VBVXISQEKXSPKD-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00240702
0 references
NSC number
61909
0 references
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