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(Q82854170)
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English
2-Methoxy-1-({2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl}methyl)-1H-benzimidazole-7-carboxylic 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
668.2535888839999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₂H₃₂N₆O₃
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canonical SMILES
COC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NN=NN5C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C(=O)O
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Identifiers
InChI
InChI=1S/C42H32N6O3/c1-51-41-43-37-23-13-22-36(40(49)50)38(37)47(41)28-29-24-26-30(27-25-29)34-20-11-12-21-35(34)39-44-45-46-48(39)42(31-14-5-2-6-15-31,32-16-7-3-8-17-32)33-18-9-4-10-19-33/h2-27H,28H2,1H3,(H,49,50)
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InChIKey
ZNEXASATSUWRGN-UHFFFAOYSA-N
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CAS Registry Number
1246820-94-9
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PubChem CID
71752861
1 reference
matched by identifier from
InChIKey
InChIKey
ZNEXASATSUWRGN-UHFFFAOYSA-N
UniChem compound ID
23152164
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40858547
1 reference
matched by identifier from
InChIKey
InChIKey
ZNEXASATSUWRGN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10809288
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