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(Q83073886)
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English
1-Benzoylpiperidine-4-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
233.2636
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₅NO₃
0 references
canonical SMILES
C1CN(CCC1C(=O)O)C(=O)C2=CC=CC=C2
0 references
Identifiers
InChI
InChI=1S/C13H15NO3/c15-12(10-4-2-1-3-5-10)14-8-6-11(7-9-14)13(16)17/h1-5,11H,6-9H2,(H,16,17)
0 references
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
0 references
CAS Registry Number
5274-99-7
1 reference
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=5274-99-7
PubChem CID
78935
1 reference
matched by identifier from
InChIKey
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL1673861
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
UniChem compound ID
23651596
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00200725
1 reference
matched by identifier from
InChIKey
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30123216
0 references
NSC number
15149
0 references
UNII
T35JDD6EKE
1 reference
matched by identifier from
InChIKey
InChIKey
ZTGMNCCDDKBPML-UHFFFAOYSA-N
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