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: QCLFUDXLJNWJEP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
11034856

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-20(17-6-4-3-5-7-17)28-22(30)18-10-12-29(13-11-18)21-9-8-19(15-27-21)23(24,25)26/h3-9,15-16,18,20H,10-14H2,1-2H3,(H,28,30)
C23H28F3N3O419.48319700
7814246

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-20(17-6-4-3-5-7-17)28-22(30)18-10-12-29(13-11-18)21-9-8-19(15-27-21)23(24,25)26/h3-9,15-16,18,20H,10-14H2,1-2H3,(H,28,30)/t20-/m0/s1
C23H28F3N3O419.48312100
7814248

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-20(17-6-4-3-5-7-17)28-22(30)18-10-12-29(13-11-18)21-9-8-19(15-27-21)23(24,25)26/h3-9,15-16,18,20H,10-14H2,1-2H3,(H,28,30)/t20-/m1/s1
C23H28F3N3O419.48312100
7814245

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-20(17-6-4-3-5-7-17)28-22(30)18-10-12-29(13-11-18)21-9-8-19(15-27-21)23(24,25)26/h3-9,15-16,18,20H,10-14H2,1-2H3,(H,28,30)/p+1/t20-/m0/s1
C23H29F3N3O420.49051100
7814247

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-20(17-6-4-3-5-7-17)28-22(30)18-10-12-29(13-11-18)21-9-8-19(15-27-21)23(24,25)26/h3-9,15-16,18,20H,10-14H2,1-2H3,(H,28,30)/p+1/t20-/m1/s1
C23H29F3N3O420.49051100

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