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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 9 results

Search term: AAPVQEMYVNZIOO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
13338

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2
C9H6Cl6O4S422.92452313200
24773402

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3?,4?,7-,8+
C9H6Cl6O4S422.9245122717228
16736500

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7+,8-
C9H6Cl6O4S422.924592117229
52084733

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7-,8+
C9H6Cl6O4S422.92455500
77499267

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7-,8-/m1/s1/i1D2,2D2
C9H2D4Cl6O4S426.94924600
78315467

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7?,8?
C9H6Cl6O4S422.92453600
64835168

2 of 4 defined stereocentres - 2/4 defined

Non-standard isotope
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3?,4?,7-,8+/i1D2,2D2
C9H2D4Cl6O4S426.94922300
114814894

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3?,4?,7-,8-/m1/s1
C9H6Cl6O4S422.92451100
58783140

2 of 4 defined stereocentres - 2/4 defined

Non-standard isotope
InChI=1/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2/t3-,4+,7?,8?/i1D2,2D2
C9H2D4Cl6O4S426.94921100

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