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: LLJIJCDEHHTIBW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28600762

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9+,12-/m1/s1
C12H20N2O5S304.3626131200
61440380

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9?,12+/m1/s1
C12H20N2O5S304.36261100
96442757

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9?,12?/m1/s1
C12H20N2O5S304.36261100
97506767

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9-,12-/m1/s1
C12H20N2O5S304.36261100
110093034

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9+,12-/m0/s1
C12H20N2O5S304.36261100
113608050

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20N2O5S/c1-11(2,3)19-10(15)14-5-8-4-9-12(7-14,18-8)6-13-20(9,16)17/h8-9,13H,4-7H2,1-3H3/t8-,9+,12+/m0/s1
C12H20N2O5S304.36261100

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