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 11 results

Search term: BXPMAGSOWXBZHS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7843407

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+
C7H14N2O3S206.26275013800
34451724

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)
C7H14N2O3S206.262791200
48057936

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+/i3D3
C7H11D3N2O3S209.28115700
49072040

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+/i3+1D3,6+1
C513C2H11D3N2O3S211.26653600
16740687

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5-
C7H14N2O3S206.26273400
107434186

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+/i1+1,2+1,3+1
C413C3H14N2O3S209.24062200
34985628

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+/t13-/m1/s1
C7H14N2O3S206.26271200
34985629

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+/t13-/m0/s1
C7H14N2O3S206.26271200
34987481

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5-/t13-/m1/s1
C7H14N2O3S206.26271200
34987482

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5-/t13-/m0/s1
C7H14N2O3S206.26271200

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