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(Q82565466)
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English
2-{[(Benzyloxy)carbonyl]amino}-4-chlorobenzoic acid
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
305.7136
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₂ClNO₄
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canonical SMILES
C1=CC=C(C=C1)COC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O
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Identifiers
InChI
InChI=1S/C15H12ClNO4/c16-11-6-7-12(14(18)19)13(8-11)17-15(20)21-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,17,20)(H,18,19)
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InChIKey
QWCJAHVNRQXIJE-UHFFFAOYSA-N
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CAS Registry Number
112733-44-5
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PubChem CID
29299845
1 reference
matched by identifier from
InChIKey
InChIKey
QWCJAHVNRQXIJE-UHFFFAOYSA-N
UniChem compound ID
25958398
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60651951
1 reference
matched by identifier from
InChIKey
InChIKey
QWCJAHVNRQXIJE-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60602701
0 references
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