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 5 results

Search term: VGWPKJGHJBPYFU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2152385

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O5/c1-23(12-11-15-5-10-19(28-3)20(13-15)29-4)18-14-21(25)24(22(18)26)16-6-8-17(27-2)9-7-16/h5-10,13,18H,11-12,14H2,1-4H3
C22H26N2O5398.45224281900
891891

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H26N2O5/c1-23(12-11-15-5-10-19(28-3)20(13-15)29-4)18-14-21(25)24(22(18)26)16-6-8-17(27-2)9-7-16/h5-10,13,18H,11-12,14H2,1-4H3/t18-/m0/s1
C22H26N2O5398.45222100
891892

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H26N2O5/c1-23(12-11-15-5-10-19(28-3)20(13-15)29-4)18-14-21(25)24(22(18)26)16-6-8-17(27-2)9-7-16/h5-10,13,18H,11-12,14H2,1-4H3/t18-/m1/s1
C22H26N2O5398.45222100
5331691

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H26N2O5/c1-23(12-11-15-5-10-19(28-3)20(13-15)29-4)18-14-21(25)24(22(18)26)16-6-8-17(27-2)9-7-16/h5-10,13,18H,11-12,14H2,1-4H3/p+1/t18-/m0/s1
C22H27N2O5399.460181100
5331692

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H26N2O5/c1-23(12-11-15-5-10-19(28-3)20(13-15)29-4)18-14-21(25)24(22(18)26)16-6-8-17(27-2)9-7-16/h5-10,13,18H,11-12,14H2,1-4H3/p+1/t18-/m1/s1
C22H27N2O5399.460181100

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