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 15 results

Search term: XUZQAPSYNYIKSR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9648473

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9+,10+,11-,12+/m0/s1
C12H17BrO7353.1632282600
9307059

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9-,10+,11+,12+/m0/s1
C12H17BrO7353.1632191600
9090435

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9+,10+,11-,12+/m1/s1
C12H17BrO7353.163210700
2562495

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3
C12H17BrO7353.16325200
9177868

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9-,10+,11+,12?/m0/s1
C12H17BrO7353.16323200
23977113

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5?,9-,10+,11+,12-/m1/s1
C12H17BrO7353.16323200
18766596

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9+,10+,11-,12?/m1/s1
C12H17BrO7353.16322100
18853599

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9+,10+,11-,12-/m0/s1
C12H17BrO7353.16322300
110416233

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5-,9+,10+,11+,12+/m0/s1
C12H17BrO7353.16322300
29788333

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5?,9-,10?,11?,12-/m1/s1
C12H17BrO7353.16321100
29788357

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5?,9-,10?,11?,12u/m1/s1
C12H17BrO7353.16321100
57426173

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5?,9-,10?,11?,12?/m1/s1
C12H17BrO7353.16321100
71116105

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C12H17BrO7/c1-5-9(18-6(2)14)10(19-7(3)15)11(12(13)17-5)20-8(4)16/h5,9-12H,1-4H3/t5?,9-,10+,11?,12-/m1/s1
C12H17BrO7353.16321100

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