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 5 results

Search term: DBEFCWICFAVKKV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2112472

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H12N4O2/c17-16(18)9-3-1-2-8(6-9)11-12-10(4-5-13-11)14-7-15-12/h1-3,6-7,11,13H,4-5H2,(H,14,15)
C12H12N4O2244.24928181400
655497

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H12N4O2/c17-16(18)9-3-1-2-8(6-9)11-12-10(4-5-13-11)14-7-15-12/h1-3,6-7,11,13H,4-5H2,(H,14,15)/t11-/m0/s1
C12H12N4O2244.24932100
655502

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H12N4O2/c17-16(18)9-3-1-2-8(6-9)11-12-10(4-5-13-11)14-7-15-12/h1-3,6-7,11,13H,4-5H2,(H,14,15)/t11-/m1/s1
C12H12N4O2244.24932100
5310461

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H12N4O2/c17-16(18)9-3-1-2-8(6-9)11-12-10(4-5-13-11)14-7-15-12/h1-3,6-7,11,13H,4-5H2,(H,14,15)/p+1/t11-/m0/s1
C12H13N4O2245.257221100
5310462

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H12N4O2/c17-16(18)9-3-1-2-8(6-9)11-12-10(4-5-13-11)14-7-15-12/h1-3,6-7,11,13H,4-5H2,(H,14,15)/p+1/t11-/m1/s1
C12H13N4O2245.257221100

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