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 9 results

Search term: QAKGSPPUDHAFJM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2957182

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)
C14H16N2O5S324.35224201800
5448592

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/t9-,11-/m0/s1
C14H16N2O5S324.35222100
5448594

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/t9-,11+/m1/s1
C14H16N2O5S324.35222100
5448596

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/t9-,11+/m0/s1
C14H16N2O5S324.35222100
5448598

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/t9-,11-/m1/s1
C14H16N2O5S324.35222100
5448597

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/p-2/t9-,11-/m1/s1
C14H14N2O5S322.33751100
5448595

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/p-2/t9-,11+/m0/s1
C14H14N2O5S322.33751100
5448593

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/p-2/t9-,11+/m1/s1
C14H14N2O5S322.33751100
5448591

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H16N2O5S/c1-7-4-3-5-8(2)10(7)15-14(21)16-9(12(17)18)6-22-11(16)13(19)20/h3-5,9,11H,6H2,1-2H3,(H,15,21)(H,17,18)(H,19,20)/p-2/t9-,11-/m0/s1
C14H14N2O5S322.33751100

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