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: SDKXGAICTNHFCN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4529404

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3+/t6-,10-/m0/s1
C12H12O5236.2207263100
4524383

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3+
C12H12O5236.2207112700
522936

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3
C12H12O5236.22075300
554145

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3+/t6-,10-/m1/s1
C12H12O5236.22073200
65501

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/t6-,10-/m0/s1
C12H12O5236.22072100
62622137

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3-/t6-,10+/m0/s1
C12H12O5236.22072200
78436286

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3+/t6-,10+/m0/s1
C12H12O5236.22071100

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