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: IADUEWIQBXOCDZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
16360

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)
C4H7NO2101.103916432722046
15628

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1
C4H7NO2101.103914310400
553202

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m1/s1
C4H7NO2101.1039966600
107444811

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m1/s1/i1D2,2D2
C4H3D4NO2105.12852200
10646176

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/p-1
C4H6NO2100.096512700
107434605

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/i1D2,2D2
C4H3D4NO2105.12851200
107435385

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/i1D2,2D2,3D
C4H2D5NO2106.13471200
107444797

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1/i1D2,2D2
C4H3D4NO2105.12851100

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