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
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Found 6 results

Search term: NYRMIJKDBAQCHC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
82853

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3
C18H14F3NO2333.3045589100
64808303

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3/t16-/m0/s1
C18H14F3NO2333.30452300
71048247

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3/i5+2,8+2,9+2,10+2,12+2,13+2
C1214C6H14F3NO2345.25971100
71048248

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3/i2+2,3+2,4+2,6+2,7+2,11+2
C1214C6H14F3NO2345.25971100
71048249

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3/i17+2
C1714CH14F3NO2335.2971100
95723033

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3/i/hD
C18H13DF3NO2334.31061100

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