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 20 results

Search term: AYIRNRDRBQJXIF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
102776


2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1
C12H14Cl2FNO4S358.2133107993653
4372750

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)
C12H14Cl2FNO4S358.21326324123600
71081641

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1/i1D3
C12H11D3Cl2FNO4S361.2317101200
5036717

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m0/s1
C12H14Cl2FNO4S358.21338600
32770029

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10+/m0/s1
C12H14Cl2FNO4S358.21338700
21498481

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9?,10-/m1/s1
C12H14Cl2FNO4S358.21335200
48060043

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m0/s1/i6D2,9D
C12H11D3Cl2FNO4S361.23174400
21470443

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10?/m0/s1
C12H14Cl2FNO4S358.21333300
68897769

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m0/s1/i1D3
C12H11D3Cl2FNO4S361.23172200
76871162

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1/i6D2,9D
C12H11D3Cl2FNO4S361.23172200
77431649

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m0/s1/i9D
C12H13DCl2FNO4S359.21942300
8060794

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10?/m1/s1
C12H14Cl2FNO4S358.21332100
29789855

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9?,10-/m0/s1
C12H14Cl2FNO4S358.21331100
48060042

1 of 2 defined stereocentres - 1/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9?,10-/m1/s1/i6D2,9D
C12H11D3Cl2FNO4S361.23171100
111133648

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/i6D2,9D
C12H11D3Cl2FNO4S361.23171100
114725128

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1/i6D2
C12H12D2Cl2FNO4S360.22561100
68026316

1 of 2 defined stereocentres - 1/2 defined

Non-standard isotope
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9?,10-/m0/s1/i9D
C12H13DCl2FNO4S359.21941100
71116498

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10+/m1/s1
C12H14Cl2FNO4S358.21331100

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