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: OMKHWTRUYNAGFG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
65874

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10-,11+/m1/s1
C12H14N4O3262.26465642491
317988

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)
C12H14N4O3262.2646122900
5145079

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10+,11-/m0/s1
C12H14N4O3262.26466500
29315041

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10-,11-/m1/s1
C12H14N4O3262.26464200
314623

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10?,11?/m1/s1
C12H14N4O3262.26463200
62426548

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10+,11+/m0/s1
C12H14N4O3262.26463300
62426549

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10-,11+/m0/s1
C12H14N4O3262.26463300
62426550

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10-,11-/m0/s1
C12H14N4O3262.26462200
58842632

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10+,11-/m1/s1
C12H14N4O3262.26462200
62426547

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10+,11+/m1/s1
C12H14N4O3262.26462200
110449639

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10+,11?/m1/s1
C12H14N4O3262.26461100
129034142

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8?,10-,11-/m1/s1
C12H14N4O3262.26461100
21202233

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/p+1/t8-,10-,11+/m1/s1
C12H15N4O3263.2721100

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