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(Q82296227)
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English
Benzoic acid, 4-[[(2-naphthalenylmethyl)amino]methyl]-, methyl ester
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
305.3711
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₉NO₂
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canonical SMILES
COC(=O)C1=CC=C(C=C1)CNCC2=CC3=CC=CC=C3C=C2
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Identifiers
InChI
InChI=1S/C20H19NO2/c1-23-20(22)18-10-6-15(7-11-18)13-21-14-16-8-9-17-4-2-3-5-19(17)12-16/h2-12,21H,13-14H2,1H3
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InChIKey
ZUBCMHZNERVFJI-UHFFFAOYSA-N
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CAS Registry Number
905818-73-7
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PubChem CID
11573081
1 reference
matched by identifier from
InChIKey
InChIKey
ZUBCMHZNERVFJI-UHFFFAOYSA-N
UniChem compound ID
34332986
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40468807
1 reference
matched by identifier from
InChIKey
InChIKey
ZUBCMHZNERVFJI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30419626
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