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 10 results

Search term: QCHPKSFMDHPSNR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
58481

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)
C4H9NO2103.119812937516724
388543

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
C4H9NO2103.1198828900
4573585

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1
C4H9NO2103.1198767307
4573834

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/p-1/t3-/m0/s1
C4H8NO2102.11245420
14193508

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/p-1
C4H8NO2102.1124422264
20126569

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/p-1/t3-/m1/s1
C4H8NO2102.11243413
24533148

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/i2D2,3D
C4H6D3NO2106.13823600
396851

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/i1-1
C311CH9NO2102.12052200
8733968

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/i1D3,2D2,3D
C4H3D6NO2109.15672100
8829536

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/i4+1
C313CH9NO2104.11242100

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