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 8 results

Search term: WFVKUPXLIMZXQM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4505782

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3
C22H23NO4365.4223211400
4562924

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/t14-,15+
C22H23NO4365.42232100
4562925

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/t14-,15-/m1/s1
C22H23NO4365.42232100
4562926

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/t14-,15-/m0/s1
C22H23NO4365.42232100
5335951

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/p+1/t14-,15+
C22H24NO4366.42972200
5335952

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/p+1/t14-,15-/m1/s1
C22H24NO4366.42971100
5335953

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/p+1/t14-,15-/m0/s1
C22H24NO4366.42971100
4860534

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H23NO4/c1-14-11-23(12-15(2)26-14)13-19-20(24)9-8-17-18(10-21(25)27-22(17)19)16-6-4-3-5-7-16/h3-10,14-15,24H,11-13H2,1-2H3/p+1
C22H24NO4366.42971100

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