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 8 results

Search term: JBDHZKLJNAIJNC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
83449

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1
C17H13ClFNO4349.74088693131
5291880

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3
C17H13ClFNO4349.7408232324500
24721910

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m0/s1
C17H13ClFNO4349.74084200
58780684

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1/i4+1,5+1,6+1,7+1,13+1,14+1
C1113C6H13ClFNO4355.69683300
58824821

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/i4+1,5+1,6+1,7+1,13+1,14+1
C1113C6H13ClFNO4355.69683300
58781375

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1/i4D,5D,6D,7D
C17H9D4ClFNO4353.76552200
71048306

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1/i16+2
C1614CH13ClFNO4351.73341100
71048312

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1/i4+2,5+2,6+2,7+2,13+2,14+2
C1114C6H13ClFNO4361.69611100

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