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: PWQBFQOMFVQBTE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
58769

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C11H14BrNO4S/c1-6(14)13-8(11(16)17)5-18-10-3-2-7(12)4-9(10)15/h2-4,8-10,15H,5H2,1H3,(H,13,14)(H,16,17)/t8-,9?,10?/m0/s1
C11H14BrNO4S336.20226700
19969471

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H14BrNO4S/c1-6(14)13-8(11(16)17)5-18-10-3-2-7(12)4-9(10)15/h2-4,8-10,15H,5H2,1H3,(H,13,14)(H,16,17)
C11H14BrNO4S336.20221200
21202457

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H14BrNO4S/c1-6(14)13-8(11(16)17)5-18-10-3-2-7(12)4-9(10)15/h2-4,8-10,15H,5H2,1H3,(H,13,14)(H,16,17)/p-1/t8-,9+,10-/m0/s1
C11H13BrNO4S335.19481100

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