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: DWNZLQPWQLNPRS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2052417

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16O5/c1-8-13(20-9(2)15(17)18)7-6-11-10-4-3-5-12(10)16(19)21-14(8)11/h6-7,9H,3-5H2,1-2H3,(H,17,18)
C16H16O5288.29524614500
5556323

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16O5/c1-8-13(20-9(2)15(17)18)7-6-11-10-4-3-5-12(10)16(19)21-14(8)11/h6-7,9H,3-5H2,1-2H3,(H,17,18)/t9-/m0/s1
C16H16O5288.29523100
5556325

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16O5/c1-8-13(20-9(2)15(17)18)7-6-11-10-4-3-5-12(10)16(19)21-14(8)11/h6-7,9H,3-5H2,1-2H3,(H,17,18)/t9-/m1/s1
C16H16O5288.29523100
5556324

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16O5/c1-8-13(20-9(2)15(17)18)7-6-11-10-4-3-5-12(10)16(19)21-14(8)11/h6-7,9H,3-5H2,1-2H3,(H,17,18)/p-1/t9-/m1/s1
C16H15O5287.28781100
5556322

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16O5/c1-8-13(20-9(2)15(17)18)7-6-11-10-4-3-5-12(10)16(19)21-14(8)11/h6-7,9H,3-5H2,1-2H3,(H,17,18)/p-1/t9-/m0/s1
C16H15O5287.28781100

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