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 3 results

Search term: RJUAJPXDDBGVQP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
61748898

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H30F3N7O/c1-16(23(29)36)20-6-4-3-5-17(20)7-8-22-21(25(26,27)28)14-30-24(33-22)32-18-13-31-35(15-18)19-9-11-34(2)12-10-19/h3-6,13-16,19H,7-12H2,1-2H3,(H2,29,36)(H,30,32,33)
C25H30F3N7O501.54723500
76801402

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H30F3N7O/c1-16(23(29)36)20-6-4-3-5-17(20)7-8-22-21(25(26,27)28)14-30-24(33-22)32-18-13-31-35(15-18)19-9-11-34(2)12-10-19/h3-6,13-16,19H,7-12H2,1-2H3,(H2,29,36)(H,30,32,33)/t16-/m1/s1
C25H30F3N7O501.54723300
76824784

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H30F3N7O/c1-16(23(29)36)20-6-4-3-5-17(20)7-8-22-21(25(26,27)28)14-30-24(33-22)32-18-13-31-35(15-18)19-9-11-34(2)12-10-19/h3-6,13-16,19H,7-12H2,1-2H3,(H2,29,36)(H,30,32,33)/t16-/m0/s1
C25H30F3N7O501.54723300

Advertisement