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: PKVWLAZMWYDPCN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2023358

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-18-4-6-19(7-5-18)17(3)22(30)29-12-10-28(11-13-29)21-9-8-20(15-27-21)23(24,25)26/h4-9,15-17H,10-14H2,1-3H3
C23H28F3N3O419.483129612800
5557347

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-18-4-6-19(7-5-18)17(3)22(30)29-12-10-28(11-13-29)21-9-8-20(15-27-21)23(24,25)26/h4-9,15-17H,10-14H2,1-3H3/t17-/m1/s1
C23H28F3N3O419.48312100
5557349

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-18-4-6-19(7-5-18)17(3)22(30)29-12-10-28(11-13-29)21-9-8-20(15-27-21)23(24,25)26/h4-9,15-17H,10-14H2,1-3H3/t17-/m0/s1
C23H28F3N3O419.48312100
5557348

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-18-4-6-19(7-5-18)17(3)22(30)29-12-10-28(11-13-29)21-9-8-20(15-27-21)23(24,25)26/h4-9,15-17H,10-14H2,1-3H3/p+1/t17-/m0/s1
C23H29F3N3O420.49051100
5557346

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H28F3N3O/c1-16(2)14-18-4-6-19(7-5-18)17(3)22(30)29-12-10-28(11-13-29)21-9-8-20(15-27-21)23(24,25)26/h4-9,15-17H,10-14H2,1-3H3/p+1/t17-/m1/s1
C23H29F3N3O420.49051100

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