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(Q83086805)
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English
1H-Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-, (benzoyloxy)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
491.11356510399986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₂₂ClNO₆
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canonical SMILES
CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCOC(=O)C4=CC=CC=C4
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Identifiers
InChI
InChI=1S/C27H22ClNO6/c1-17-22(15-25(30)34-16-35-27(32)19-6-4-3-5-7-19)23-14-21(33-2)12-13-24(23)29(17)26(31)18-8-10-20(28)11-9-18/h3-14H,15-16H2,1-2H3
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InChIKey
SPOHBRIBTFAVAK-UHFFFAOYSA-N
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CAS Registry Number
62751-72-8
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PubChem CID
44151
1 reference
matched by identifier from
InChIKey
InChIKey
SPOHBRIBTFAVAK-UHFFFAOYSA-N
UniChem compound ID
48218049
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30211824
1 reference
matched by identifier from
InChIKey
InChIKey
SPOHBRIBTFAVAK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60134315
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