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 4 results

Search term: JRIGDKIATMFDRU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3627902

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C11H16N4O4/c1-7-4-14(5-8(2)19-7)11(16)10-9(15(17)18)6-13(3)12-10/h6-8H,4-5H2,1-3H3
C11H16N4O4268.26914231600
790394

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H16N4O4/c1-7-4-14(5-8(2)19-7)11(16)10-9(15(17)18)6-13(3)12-10/h6-8H,4-5H2,1-3H3/t7-,8+
C11H16N4O4268.26913200
790395

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H16N4O4/c1-7-4-14(5-8(2)19-7)11(16)10-9(15(17)18)6-13(3)12-10/h6-8H,4-5H2,1-3H3/t7-,8-/m1/s1
C11H16N4O4268.26912100
790396

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H16N4O4/c1-7-4-14(5-8(2)19-7)11(16)10-9(15(17)18)6-13(3)12-10/h6-8H,4-5H2,1-3H3/t7-,8-/m0/s1
C11H16N4O4268.26912100

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