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 5 results

Search term: XYLJNMCMDOOJRW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8014481

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3
C9H13FN2O3S248.2745161500
8014483

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3/t9-/m0/s1
C9H13FN2O3S248.2745141200
8740564

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3/t9-/m0/s1/i5+2
C814CH13FN2O3S250.26711200
128920095

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3/p+1/t9-/m0/s1
C9H14FN2O3S249.28191100
8011232

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3/t9-/m1/s1
C9H13FN2O3S248.27451100

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