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 6 results

Search term: AOSGDBLMPHPJQU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28557627

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)
C5H9NO4S179.19436500
28639384

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3?/m0/s1
C5H9NO4S179.19434500
57532657

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3?/m1/s1
C5H9NO4S179.19433200
59053692

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3+/m0/s1
C5H9NO4S179.19432200
59051482

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1
C5H9NO4S179.19431100
28639383

Charge

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/p-1/t2-,3?/m0/s1
C5H8NO4S178.18691100

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