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: SCLFETMCMRCGEO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
242660

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3
C13H19NO5269.2937201800
13007386

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10-,11+,12-,13-/m1/s1
C13H19NO5269.29379800
168053

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10-,11+,12-,13?/m1/s1
C13H19NO5269.29375500
4497095

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10-,11+,12+,13-/m1/s1
C13H19NO5269.29374400
671503

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10+,11-,12-,13-/m1/s1
C13H19NO5269.29373300
1139524

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10-,11-,12-,13-/m1/s1
C13H19NO5269.29373300
62490742

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10-,11+,12-,13+/m0/s1
C13H19NO5269.29372200
5028090

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10+,11+,12+,13+/m0/s1
C13H19NO5269.29372100
5424031

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10+,11+,12+,13-/m0/s1
C13H19NO5269.29372100
5424032

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10+,11+,12-,13-/m0/s1
C13H19NO5269.29372100
5424033

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H19NO5/c1-7-2-4-8(5-3-7)14-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3/t9-,10+,11+,12-,13+/m0/s1
C13H19NO5269.29372100

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