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(Q82271456)
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English
3-Isoquinolinecarboxylicacid, 1-(2-chlorophenyl)-
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
283.04000623999997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₀ClNO₂
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canonical SMILES
C1=CC=C2C(=C1)C=C(N=C2C3=CC=CC=C3Cl)C(=O)O
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Identifiers
InChI
InChI=1S/C16H10ClNO2/c17-13-8-4-3-7-12(13)15-11-6-2-1-5-10(11)9-14(18-15)16(19)20/h1-9H,(H,19,20)
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InChIKey
JBRVJPXJLHEUND-UHFFFAOYSA-N
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CAS Registry Number
89242-09-1
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PubChem CID
11000554
1 reference
matched by identifier from
InChIKey
InChIKey
JBRVJPXJLHEUND-UHFFFAOYSA-N
UniChem compound ID
25884512
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20451434
1 reference
matched by identifier from
InChIKey
InChIKey
JBRVJPXJLHEUND-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10402253
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