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 11 results

Search term: WOUNTSATDZJBLP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5382246

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8+/m0/s1
C11H17NO4227.257866200
5382248

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8+/m1/s1
C11H17NO4227.257834300
5506285

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8-/m0/s1
C11H17NO4227.257684500
2016239

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)
C11H17NO4227.25698333900
5506283

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8-/m1/s1
C11H17NO4227.257191700
5382245

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/p-1/t7-,8+/m0/s1
C11H16NO4226.24963200
26477876

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7?,8-/m0/s1
C11H17NO4227.2573200
26477879

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/t7?,8-/m1/s1
C11H17NO4227.2573200
5382247

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/p-1/t7-,8+/m1/s1
C11H16NO4226.24962200
5506284

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/p-1/t7-,8-/m0/s1
C11H16NO4226.24961100
5506282

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H17NO4/c1-11(2,3)16-10(15)12-8-5-4-7(6-8)9(13)14/h4-5,7-8H,6H2,1-3H3,(H,12,15)(H,13,14)/p-1/t7-,8-/m1/s1
C11H16NO4226.24961100

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