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: WKCPETHKZWDBLE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
287753

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C9H13N3O6/c1-3-5(14)6(15)7(16)8(18-3)12-9(17)11-4(13)2-10-12/h2-3,5-8,14-16H,1H3,(H,11,13,17)
C9H13N3O6259.2164300
62300586

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H13N3O6/c1-3-5(14)6(15)7(16)8(18-3)12-9(17)11-4(13)2-10-12/h2-3,5-8,14-16H,1H3,(H,11,13,17)/t3-,5-,6+,7+,8-/m1/s1
C9H13N3O6259.2162200
62480208

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H13N3O6/c1-3-5(14)6(15)7(16)8(18-3)12-9(17)11-4(13)2-10-12/h2-3,5-8,14-16H,1H3,(H,11,13,17)/t3-,5+,6-,7-,8+/m0/s1
C9H13N3O6259.2162200
21211166

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C9H13N3O6/c1-3-5(14)6(15)7(16)8(18-3)12-9(17)11-4(13)2-10-12/h2-3,5-8,14-16H,1H3,(H,11,13,17)/t3-,5+,6+,7+,8-/m1/s1
C9H13N3O6259.2161100

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