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 8 results

Search term: YTGJWQPHMWSCST (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5283

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)
C5H9NO3S163.194911054829470
180938

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/t3-/m1/s1
C5H9NO3S163.1949171800
643292

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/t3-/m0/s1
C5H9NO3S163.1949111000
68023313

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/i2+1
C413CH9NO3S164.18752300
95586534

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/p-1
C5H8NO3S162.18751100
5305580

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/p-1/t3-/m0/s1
C5H8NO3S162.186921100
5408959

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/p-1/t3-/m1/s1
C5H8NO3S162.18751100

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