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 7 results

Search term: WWRNUKIXISJYIB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3868995

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)
C8H16N4O2200.2382131300
17460815

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5?,6-/m1/s1
C8H16N4O2200.238212900
5428738

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5-,6-/m1/s1
C8H16N4O2200.23822100
5428739

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5-,6+/m0/s1
C8H16N4O2200.23822100
808978

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5-,6-/m0/s1
C8H16N4O2200.23822100
808979

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5-,6+/m1/s1
C8H16N4O2200.23822100
113598746

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C8H16N4O2/c1-5-4-6(11-7(13)9-2)12(3)8(14)10-5/h5-6H,4H2,1-3H3,(H,10,14)(H2,9,11,13)/t5?,6-/m0/s1
C8H16N4O2200.23821100

Advertisement