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 5 results

Search term: KTIOQJISOHJZQO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4729112

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H18N8O6/c19-17-22-13-10(15(31)23-17)21-18(26(13)16-12(29)11(28)8(5-27)32-16)25-24-9-6-3-1-2-4-7(6)20-14(9)30/h1-4,8,11-12,16,27-29H,5H2,(H,21,25)(H,20,24,30)(H3,19,22,23,31)
C18H18N8O6442.38558400
5882909

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H18N8O6/c19-17-22-13-10(15(31)23-17)21-18(26(13)16-12(29)11(28)8(5-27)32-16)25-24-9-6-3-1-2-4-7(6)20-14(9)30/h1-4,8,11-12,16,27-29H,5H2,(H,21,25)(H,20,24,30)(H3,19,22,23,31)/t8-,11+,12-,16+/m0/s1
C18H18N8O6442.38553200
5882892

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H18N8O6/c19-17-22-13-10(15(31)23-17)21-18(26(13)16-12(29)11(28)8(5-27)32-16)25-24-9-6-3-1-2-4-7(6)20-14(9)30/h1-4,8,11-12,16,27-29H,5H2,(H,21,25)(H,20,24,30)(H3,19,22,23,31)/t8-,11+,12+,16-/m0/s1
C18H18N8O6442.38552100
5882895

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H18N8O6/c19-17-22-13-10(15(31)23-17)21-18(26(13)16-12(29)11(28)8(5-27)32-16)25-24-9-6-3-1-2-4-7(6)20-14(9)30/h1-4,8,11-12,16,27-29H,5H2,(H,21,25)(H,20,24,30)(H3,19,22,23,31)/t8-,11+,12+,16+/m0/s1
C18H18N8O6442.38552100
5882898

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H18N8O6/c19-17-22-13-10(15(31)23-17)21-18(26(13)16-12(29)11(28)8(5-27)32-16)25-24-9-6-3-1-2-4-7(6)20-14(9)30/h1-4,8,11-12,16,27-29H,5H2,(H,21,25)(H,20,24,30)(H3,19,22,23,31)/t8-,11+,12-,16-/m0/s1
C18H18N8O6442.38552100

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