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: CQMKXRSRPTYYJJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
576769

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H20O5/c1-4-5-6-12-9-15(18)22-14-8-10(2)7-13(16(12)14)21-11(3)17(19)20/h7-9,11H,4-6H2,1-3H3,(H,19,20)
C17H20O5304.3377423100
1510581

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H20O5/c1-4-5-6-12-9-15(18)22-14-8-10(2)7-13(16(12)14)21-11(3)17(19)20/h7-9,11H,4-6H2,1-3H3,(H,19,20)/t11-/m0/s1
C17H20O5304.33772100
1510584

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H20O5/c1-4-5-6-12-9-15(18)22-14-8-10(2)7-13(16(12)14)21-11(3)17(19)20/h7-9,11H,4-6H2,1-3H3,(H,19,20)/t11-/m1/s1
C17H20O5304.33772100
1510583

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H20O5/c1-4-5-6-12-9-15(18)22-14-8-10(2)7-13(16(12)14)21-11(3)17(19)20/h7-9,11H,4-6H2,1-3H3,(H,19,20)/p-1/t11-/m0/s1
C17H19O5303.33031100
1510580

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H20O5/c1-4-5-6-12-9-15(18)22-14-8-10(2)7-13(16(12)14)21-11(3)17(19)20/h7-9,11H,4-6H2,1-3H3,(H,19,20)/p-1/t11-/m1/s1
C17H19O5303.33031100

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