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 22 results

Search term: FEYHMSUYKIMUAL (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
144932

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8+/m0/s1
C10H16N2O5244.24444394472471108
3214048

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)
C10H16N2O5244.2444102600
138332

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6+,7-,8-/m1/s1
C10H16N2O5244.24444300
1062941

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6-,7+,8+/m0/s1
C10H16N2O5244.24443100
599906

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6+,7-,8-/m0/s1
C10H16N2O5244.24442100
110102326

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8+/m1/s1
C10H16N2O5244.24442200
5608267

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6+,7+,8+/m1/s1
C10H16N2O5244.24442100
5608269

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6-,7-,8-/m0/s1
C10H16N2O5244.24442100
5608270

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6+,7+,8-/m1/s1
C10H16N2O5244.24442100
5608271

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6-,7-,8+/m0/s1
C10H16N2O5244.24442100
8281438

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8+/m0/s1/i5D
C10H15DN2O5245.25062200
58825339

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6?,7-,8-/m1/s1
C10H16N2O5244.24441100
95600845

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5-,6-,7+,8-/m0/s1
C10H16N2O5244.24441100
109483929

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8-/m1/s1
C10H16N2O5244.24441100
109486173

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7-,8-/m1/s1/i1D3
C10H13D3N2O5247.26291100
128924514

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7-,8-/m1/s1/i4+2
C914CH16N2O5246.2371100
128924622

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7-,8-/m1/s1
C10H16N2O5244.24441100
128925039

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8+/m0/s1/i1D3
C10H13D3N2O5247.26291100
128925706

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7-,8-/m1/s1/i1D3,3D/t3?,5?,6-,7-,8-
C10H12D4N2O5248.26911100
128926207

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7-,8+/m0/s1
C10H16N2O5244.24441100
12

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