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 6 results

Search term: XWKAVQKJQBISOL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2041100

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)
C9H11NO2165.189146356242433
714570

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m0/s1
C9H11NO2165.18912043219398
714571

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m1/s1
C9H11NO2165.1891151000
114989860

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m0/s1/i2D,3D,4D,5D,6D
C9H6D5NO2170.21992200
5319662

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/p-1/t7-/m1/s1
C9H10NO2164.18121100
114989859

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H11NO2/c1-7(9(11)12)10-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m0/s1/i1D2,2D,3D,4D,5D,6D,7D
C9H3D8NO2173.23841100

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