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 7 results

Search term: JLYFCTQDENRSOL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
82842

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3
C12H18ClNO2S275.79486213520
11677313

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/t9-/m0/s1
C12H18ClNO2S275.7948435200
27472001

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/t9-/m1/s1
C12H18ClNO2S275.7948121600
58784340

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/i4D3
C12H15D3ClNO2S278.81337800
49071806

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/i1D3
C12H15D3ClNO2S278.81333300
71047770

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/i12+2
C1114CH18ClNO2S277.78741100
71048320

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3/t9-/m0/s1/i12+2
C1114CH18ClNO2S277.78741100

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