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 14 results

Search term: IAOZJIPTCAWIRG-XQMQJMAZCL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
118630


2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1
C14H18N2O5294.3031149204159095118
2155

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)
C14H18N2O5294.30318164800
5360220

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11+/m0/s1
C14H18N2O5294.3031151500
48058685

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1/i1D3
C14H15D3N2O5297.3216121200
35467017

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1/i2D,3D,4D,5D,6D
C14H13D5N2O5299.333991000
5360216

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m1/s1
C14H18N2O5294.30319800
5360218

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11+/m1/s1
C14H18N2O5294.30317600
23212145

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10?,11-/m0/s1
C14H18N2O5294.30313200
28572107

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/i1D3
C14H15D3N2O5297.32162200
67868860

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/i1D3,11D/hD
C14H13D5N2O5299.33392300
78075995

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m1/s1/i2D,3D,4D,5D,6D
C14H13D5N2O5299.33391100
78076125

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m1/s1/i1D3
C14H15D3N2O5297.32161100
2956670

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/p+1
C14H19N2O5295.311061100

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