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: JCVSLSAFAIQADW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2148292

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3
C13H14N2O4262.26126474100
619293

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3/t10-/m0/s1
C13H14N2O4262.26133100
619294

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3/t10-/m1/s1
C13H14N2O4262.26133100
3288551

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3/p+1
C13H15N2O4263.26871100
5299677

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3/p+1/t10-/m0/s1
C13H15N2O4263.26921100
5299678

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O4/c1-19-12(17)8-14-10-7-11(16)15(13(10)18)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3/p+1/t10-/m1/s1
C13H15N2O4263.26921100

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