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 7 results

Search term: KYEKLQMDNZPEFU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
118541

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4-,5-,6-/m1/s1
C8H11N3O6245.1894241800
4189657

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)
C8H11N3O6245.189445200
5639066

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4+,5+,6-/m0/s1
C8H11N3O6245.18942100
5639067

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4+,5+,6+/m0/s1
C8H11N3O6245.18942100
5639068

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4+,5-,6-/m0/s1
C8H11N3O6245.18942100
5639069

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4+,5-,6+/m0/s1
C8H11N3O6245.18942100
111310592

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O6/c12-1-3-4(13)5(14)6(17-3)11-2-9-7(15)10-8(11)16/h2-6,12-14H,1H2,(H,10,15,16)/t3-,4-,5-,6-/m0/s1
C8H11N3O6245.18941100

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