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: TVCBDTCUOVDLNZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2081197

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5-,6-,7-/m1/s1
C8H11N3O5S261.25504543800
2897580

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)
C8H11N3O5S261.25504161400
5602589

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5+,6-,7+/m0/s1
C8H11N3O5S261.2553200
35518722

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5+,6?,7-/m1/s1
C8H11N3O5S261.2552300
5145036

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5-,6+,7+/m0/s1
C8H11N3O5S261.2552100
5602586

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5+,6+,7-/m0/s1
C8H11N3O5S261.2552100
5602587

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5+,6+,7+/m0/s1
C8H11N3O5S261.2552100
5602588

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5+,6-,7-/m0/s1
C8H11N3O5S261.2552100
57491830

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5-,6-,7-/m0/s1
C8H11N3O5S261.2551100
21211314

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5-,6-,7+/m1/s1
C8H11N3O5S261.2551100
29787312

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C8H11N3O5S/c12-2-3-5(14)6(15)7(16-3)11-8(17)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,17)/t3-,5?,6?,7-/m1/s1
C8H11N3O5S261.2551100

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