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 12 results

Search term: JCSNHEYOIASGKU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
403037

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7-,8-/m1/s1
C10H12N2O4224.2133282200
373991

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3
C10H12N2O4224.213314800
5291565

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7+,8+/m0/s1
C10H12N2O4224.21328131000
10033942

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7+,8-/m1/s1
C10H12N2O4224.21332100
23646462

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6?,7-,8-/m1/s1
C10H12N2O4224.21332300
113612516

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7+,8+/m0/s1/i1D3
C10H9D3N2O4227.23182200
2063887

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6?,7-,8+/m1/s1
C10H12N2O4224.213282200
29787233

2 of 3 defined stereocentres - 2/3 defined

Non-standard isotope
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6?,7-,8-/m1/s1/i1D3
C10H9D3N2O4227.23181100
107441435

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7-,8-/m1/s1/i1D3
C10H9D3N2O4227.23181300
111308569

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7+,8+/m1/s1/i1D3
C10H9D3N2O4227.23181100
113603475

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C10H12N2O4/c1-5-3-12-8-2-6(7(4-13)15-8)16-10(12)11-9(5)14/h3,6-8,13H,2,4H2,1H3/t6-,7+,8+/m1/s1
C10H12N2O4224.21331100

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