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 3 results

Search term: CLJRXROWQGZEGK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5424601

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H27N3O6/c1-10(2)16(20(26)27)22-18(24)11(3)21-19(25)13-9-12-14(28-5)7-8-15(29-6)17(12)23(13)4/h7-11,16H,1-6H3,(H,21,25)(H,22,24)(H,26,27)/t11-,16-/m0/s1
C20H27N3O6405.444913800
4146887

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H27N3O6/c1-10(2)16(20(26)27)22-18(24)11(3)21-19(25)13-9-12-14(28-5)7-8-15(29-6)17(12)23(13)4/h7-11,16H,1-6H3,(H,21,25)(H,22,24)(H,26,27)
C20H27N3O6405.444882100
5424600

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H27N3O6/c1-10(2)16(20(26)27)22-18(24)11(3)21-19(25)13-9-12-14(28-5)7-8-15(29-6)17(12)23(13)4/h7-11,16H,1-6H3,(H,21,25)(H,22,24)(H,26,27)/p-1/t11-,16-/m0/s1
C20H26N3O6404.43751100

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