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 10 results

Search term: PCEJMSIIDXUDSN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
62

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)
C5H12N2O2132.16098171700
389160

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/t3-,4+/m0/s1
C5H12N2O2132.161101000
32972635

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/t3-,4-/m0/s1
C5H12N2O2132.1613300
4573595

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/p-1
C5H11N2O2131.15363300
21232698

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/p+1/t3-,4+/m0/s1
C5H13N2O2133.16843200
26331446

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/p+1
C5H13N2O2133.16842200
28294818

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/t3?,4-/m0/s1
C5H12N2O2132.1612100
4573563

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/p-1/t3-,4+/m0/s1
C5H11N2O2131.15362200
95601687

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C5H12N2O2/c1-3(6)2-4(7)5(8)9/h3-4H,2,6-7H2,1H3,(H,8,9)/p+1/t3-,4+/m1/s1
C5H13N2O2133.16841100

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