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 13 results

Search term: KEDWLCOPRDSQBB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21489769

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13-,14-/m0/s1
C15H19NO2245.3169513200
9131047

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13-,14+/m1/s1
C15H19NO2245.3169232400
10006341

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13-,14-/m1/s1
C15H19NO2245.3169211800
4256165

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2
C15H19NO2245.3168612500
24541002

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13+,14-/m0/s1
C15H19NO2245.31695200
9131046

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13-,14?/m1/s1
C15H19NO2245.31693300
57426322

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12?,13?,14-/m0/s1
C15H19NO2245.31692200
75094173

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12?,13-,14-/m0/s1
C15H19NO2245.31691200
75106647

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13-,14?/m0/s1
C15H19NO2245.31691200
113607534

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12-,13+,14+/m0/s1
C15H19NO2245.31691100
57426321

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C15H19NO2/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14/h1-3,5-6,12-14,16H,4,7-10H2/t12?,13?,14-/m1/s1
C15H19NO2245.31691100

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