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: RMGAYFQZCNHYKT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3623504

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H19F3N4O3/c1-13(26)24-17(16(27)28-2,18(19,20)21)25(11-14-5-8-22-9-6-14)12-15-4-3-7-23-10-15/h3-10H,11-12H2,1-2H3,(H,24,26)
C18H19F3N4O3396.3636696161100
5621592

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19F3N4O3/c1-13(26)24-17(16(27)28-2,18(19,20)21)25(11-14-5-8-22-9-6-14)12-15-4-3-7-23-10-15/h3-10H,11-12H2,1-2H3,(H,24,26)/t17-/m1/s1
C18H19F3N4O3396.36372100
5621594

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19F3N4O3/c1-13(26)24-17(16(27)28-2,18(19,20)21)25(11-14-5-8-22-9-6-14)12-15-4-3-7-23-10-15/h3-10H,11-12H2,1-2H3,(H,24,26)/t17-/m0/s1
C18H19F3N4O3396.36372100
5621593

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19F3N4O3/c1-13(26)24-17(16(27)28-2,18(19,20)21)25(11-14-5-8-22-9-6-14)12-15-4-3-7-23-10-15/h3-10H,11-12H2,1-2H3,(H,24,26)/p+1/t17-/m0/s1
C18H20F3N4O3397.37111100
5621591

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19F3N4O3/c1-13(26)24-17(16(27)28-2,18(19,20)21)25(11-14-5-8-22-9-6-14)12-15-4-3-7-23-10-15/h3-10H,11-12H2,1-2H3,(H,24,26)/p+1/t17-/m1/s1
C18H20F3N4O3397.37111100

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