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
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Found 9 results

Search term: QURNODSOJKSTBM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4436229

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m1/s1
C9H10F2N2O5264.1829064231800
59004

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5-,6-,8-/m1/s1
C9H10F2N2O5264.182911900
111837

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m0/s1
C9H10F2N2O5264.18299700
4435482

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5-,6-,8-/m0/s1
C9H10F2N2O5264.18290642200
9153493

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m1/s1/i11-1
C9H10F18FN2O5263.18542100
10122092

0 of 4 defined stereocentres - 0/4 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/i11-1
C9H10F18FN2O5263.18542200
14910699

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)
C9H10F2N2O5264.18291300
19969546

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5?,6-,8-/m1/s1
C9H10F2N2O5264.18291100
114394501

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5-,6?,8-/m1/s1/i1T
C9H9TF2N2O5266.1911100

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