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: ZMYFCFLJBGAQRS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2564795

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2
C17H13ClFN3O329.756657900
97030

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1
C17H13ClFN3O329.7564110000
9242615

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17+/m0/s1
C17H13ClFN3O329.756353000
9933985

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m0/s1
C17H13ClFN3O329.756171300
58783423

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i5D,6D,7D,8D
C17H9D4ClFN3O333.78075700
71117212

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i1D,2D,3D,4D
C17H9D4ClFN3O333.78075400
62654107

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17+/m1/s1
C17H13ClFN3O329.7562200
8719905

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i17+2
C1614CH13ClFN3O331.74862100
8719906

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i10+2
C1614CH13ClFN3O331.74862100
8792598

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i1+2,2+2,3+2,4+2,14+2,15+2
C1114C6H13ClFN3O341.71132100
9006424

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1/i5+2,6+2,7+2,8+2,12+2,13+2
C1114C6H13ClFN3O341.71132100
71047799

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/i17+2
C1614CH13ClFN3O331.74861100
71047845

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/i10+2,11+2
C1514C2H13ClFN3O333.74111100

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