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 8 results

Search term: JGORUXKMRLIJSV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
32698944

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10-,11+,16-,17-/m0/s1
C17H19NO3285.337791100
30778621

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10-,11+,16-,17-/m1/s1
C17H19NO3285.33775500
354440

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10?,11?,16?,17-/m1/s1
C17H19NO3285.33772200
8599492

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10?,11-,16?,17+/m1/s1
C17H19NO3285.33772100
9175800

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10?,11-,16+,17+/m0/s1
C17H19NO3285.33772100
57525068

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10-,11+,16+,17-/m0/s1
C17H19NO3285.33771100
107445461

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10-,11+,16-,17-/m0/s1/i1D3
C17H16D3NO3288.35611400
111312470

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C17H19NO3/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16/h2,5,10-11,16,18H,3-4,6-8H2,1H3/t10-,11+,16-,17-/m1/s1/i1D3
C17H16D3NO3288.35611100

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