Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Single/Multi-component
Isotopically Labeled
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Found 5 results

Search term: CPALRJNELRTQTO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
19350649

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H16O6/c1-13-6(4-10)8(14-2)7(12)5(11)3-9/h4-9,11-12H,3H2,1-2H3/t5-,6+,7-,8-/m1/s1
C8H16O6208.20911151109
67028353

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C8H16O6/c1-13-6(4-10)8(14-2)7(12)5(11)3-9/h4-9,11-12H,3H2,1-2H3/t5-,6+,7-,8-/m1/s1/i1D,2D
C8H14D2O6210.22141500
67030261

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C8H16O6/c1-13-6(4-10)8(14-2)7(12)5(11)3-9/h4-9,11-12H,3H2,1-2H3/t5-,6+,7+,8-/m1/s1/i1D,2D
C8H14D2O6210.22141100
67160744

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C8H16O6/c1-13-6(4-10)8(14-2)7(12)5(11)3-9/h4-9,11-12H,3H2,1-2H3/t5-,6-,7-,8-/m1/s1/i1D,2D
C8H14D2O6210.22141200

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