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 6 results

Search term: YQZHANAPVDIEHA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
166859

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)
C8H16N2O4204.2236342547
5394910

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1
C8H16N2O4204.22369800
5394912

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6+
C8H16N2O4204.22366500
5394914

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m1/s1
C8H16N2O4204.22365400
9140919

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1/i7+2,8+2
C614C2H16N2O4208.20872100
95585711

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C8H16N2O4/c9-5(7(11)12)3-1-2-4-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/p-2
C8H14N2O4202.20891100

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