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: NBAKTGXDIBVZOO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
84456

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)
C5H8N2O2128.129211623121467
589127

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/t3-/m0/s1
C5H8N2O2128.1292131000
589128

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/t3-/m1/s1
C5H8N2O2128.1292111100
8995871

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/i1D3,2D2,3D
C5H2D6N2O2134.1662101000
8829600

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/i5+1,6+0,7+0
C413CH814N2O2129.11462100
128922539

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/i1D3
C5H5D3N2O2131.14771100
128922652

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8N2O2/c1-3-2-6-5(9)7-4(3)8/h3H,2H2,1H3,(H2,6,7,8,9)/i1D3,2D
C5H4D4N2O2132.15391200

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