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: KHTSXTNOYSCKMV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4066571

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H15N3O2S/c13-6-9-3-5-18-12(9)15-11(16)8-14-7-10-2-1-4-17-10/h3,5,10,14H,1-2,4,7-8H2,(H,15,16)
C12H15N3O2S265.331411800
6402210

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15N3O2S/c13-6-9-3-5-18-12(9)15-11(16)8-14-7-10-2-1-4-17-10/h3,5,10,14H,1-2,4,7-8H2,(H,15,16)/t10-/m0/s1
C12H15N3O2S265.33142100
6402212

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15N3O2S/c13-6-9-3-5-18-12(9)15-11(16)8-14-7-10-2-1-4-17-10/h3,5,10,14H,1-2,4,7-8H2,(H,15,16)/t10-/m1/s1
C12H15N3O2S265.33142100
6402211

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15N3O2S/c13-6-9-3-5-18-12(9)15-11(16)8-14-7-10-2-1-4-17-10/h3,5,10,14H,1-2,4,7-8H2,(H,15,16)/p+1/t10-/m1/s1
C12H16N3O2S266.33881100
6402209

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H15N3O2S/c13-6-9-3-5-18-12(9)15-11(16)8-14-7-10-2-1-4-17-10/h3,5,10,14H,1-2,4,7-8H2,(H,15,16)/p+1/t10-/m0/s1
C12H16N3O2S266.33881100

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