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 14 results

Search term: HECCEGWAJYZYKW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17460021

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17?,18?,19+,20+,21-/m1/s1
C21H30O2314.461714800
5422918

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17+,18+,19+,20+,21-/m1/s1
C21H30O2314.461712800
2934845

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3
C21H30O2314.46174300
5422917

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17-,18+,19+,20+,21-/m1/s1
C21H30O2314.46172100
1181886

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17-,18-,19-,20+,21-/m0/s1
C21H30O2314.46172100
1379448

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17+,18-,19+,20-,21-/m0/s1
C21H30O2314.46172100
62633411

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17+,18-,19-,20-,21-/m1/s1
C21H30O2314.46172200
62633412

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17-,18+,19-,20-,21+/m0/s1
C21H30O2314.46172200
5422919

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17-,18-,19+,20+,21-/m1/s1
C21H30O2314.46172100
5422920

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17+,18-,19+,20+,21-/m1/s1
C21H30O2314.46172100
73991180

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17?,18?,19+,20-,21+/m1/s1
C21H30O2314.46171100
110092416

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17?,18?,19+,20+,21-/m0/s1
C21H30O2314.46171100
113598375

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O2/c1-19-9-6-15(22-3)12-14(19)4-5-16-17(19)7-10-20(2)18(16)8-11-21(20)13-23-21/h4,12,16-18H,5-11,13H2,1-3H3/t16-,17+,18+,19+,20+,21-/m0/s1
C21H30O2314.46171100

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