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 16 results

Search term: NMPOSNRHZIWLLL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
559082

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1
C18H23NO4317.3795346132210
2723

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3
C18H23NO4317.37952221000
58546

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13?,14?,15-,16+/m0/s1
C18H23NO4317.3795141300
32675194

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i2D3
C18H20D3NO4320.39861200
32675195

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i1D3,2D3,3D2
C18H15D8NO4325.42886700
48058650

0 of 4 defined stereocentres - 0/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/i2D3
C18H20D3NO4320.3983400
23126945

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14?,15+,16?/m1/s1
C18H23NO4317.37953300
23172806

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14?,15+,16-/m1/s1
C18H23NO4317.37953300
8671696

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i1D3,4D,5D,6D,7D,8D
C18H15D8NO4325.42882200
8743109

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i1D3
C18H20D3NO4320.3982200
9005001

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i4D,5D,6D,7D,8D
C18H18D5NO4322.41032200
49073106

2 of 4 defined stereocentres - 2/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15?,16?/m0/s1/i1D3,2D3,3D2
C18H15D8NO4325.42881200
78360616

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m1/s1
C18H23NO4317.37951100
34449147

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1/i1D3,3D2
C18H18D5NO4322.41031100
34997990

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16?/m0/s1/i1D3,3D2
C18H18D5NO4322.41031100

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