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: CGXZWJAUQPQBKJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10992660

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H29N3O2S2/c1-4-24-20(26)17-15-10-9-12(2)11-16(15)28-19(17)23-21(24)27-13(3)18(25)22-14-7-5-6-8-14/h12-14H,4-11H2,1-3H3,(H,22,25)
C21H29N3O2S2419.603910900
5742526

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H29N3O2S2/c1-4-24-20(26)17-15-10-9-12(2)11-16(15)28-19(17)23-21(24)27-13(3)18(25)22-14-7-5-6-8-14/h12-14H,4-11H2,1-3H3,(H,22,25)/t12-,13+/m1/s1
C21H29N3O2S2419.60392100
5742529

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H29N3O2S2/c1-4-24-20(26)17-15-10-9-12(2)11-16(15)28-19(17)23-21(24)27-13(3)18(25)22-14-7-5-6-8-14/h12-14H,4-11H2,1-3H3,(H,22,25)/t12-,13-/m1/s1
C21H29N3O2S2419.60392100
5742530

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H29N3O2S2/c1-4-24-20(26)17-15-10-9-12(2)11-16(15)28-19(17)23-21(24)27-13(3)18(25)22-14-7-5-6-8-14/h12-14H,4-11H2,1-3H3,(H,22,25)/t12-,13-/m0/s1
C21H29N3O2S2419.60392100
5742531

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H29N3O2S2/c1-4-24-20(26)17-15-10-9-12(2)11-16(15)28-19(17)23-21(24)27-13(3)18(25)22-14-7-5-6-8-14/h12-14H,4-11H2,1-3H3,(H,22,25)/t12-,13+/m0/s1
C21H29N3O2S2419.60392100

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