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 2 results

Search term: VJIHGDYNNHGNRY-XVKOCIITDO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7870940

Double-bond stereo
InChI=1/C28H22ClFN8O3/c1-16-3-5-20(13-17(16)2)33-27-34-26(32-19-6-8-21(9-7-19)38(39)40)35-28(36-27)37-31-15-22-10-12-25(41-22)18-4-11-24(30)23(29)14-18/h3-15H,1-2H3,(H3,32,33,34,35,36,37)/b31-15+
C28H22ClFN8O3572.9775131100
4354480

Double-bond stereo
InChI=1/C28H22ClFN8O3/c1-16-3-5-20(13-17(16)2)33-27-34-26(32-19-6-8-21(9-7-19)38(39)40)35-28(36-27)37-31-15-22-10-12-25(41-22)18-4-11-24(30)23(29)14-18/h3-15H,1-2H3,(H3,32,33,34,35,36,37)
C28H22ClFN8O3572.9774831999993200

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