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 2 results

Search term: PKFNIQXTCJPYGT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
74091988

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H20F6N6O2/c25-16-11-18(27)17(26)9-14(16)8-15(32-21(22(31)38)13-4-2-1-3-5-13)10-20(37)35-6-7-36-19(12-35)33-34-23(36)24(28,29)30/h1-5,9-11,21,32H,6-8,12H2,(H2,31,38)/b15-10-/t21-/m0/s1
C24H20F6N6O2538.4451100
114392370

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H20F6N6O2/c25-16-11-18(27)17(26)9-14(16)8-15(32-21(22(31)38)13-4-2-1-3-5-13)10-20(37)35-6-7-36-19(12-35)33-34-23(36)24(28,29)30/h1-5,9-11,21,32H,6-8,12H2,(H2,31,38)/b15-10-/t21-/m1/s1
C24H20F6N6O2538.4451100

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