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 4 results

Search term: UQWORKGCLUEWFL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
819087

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O4/c1-3-18-10-6-4-9(5-7-10)14-12(17)13-8(2)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)(H2,13,14,17)/t8-/m0/s1
C12H16N2O4252.2664121000
3041996

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H16N2O4/c1-3-18-10-6-4-9(5-7-10)14-12(17)13-8(2)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)(H2,13,14,17)
C12H16N2O4252.266447500
33970773

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O4/c1-3-18-10-6-4-9(5-7-10)14-12(17)13-8(2)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)(H2,13,14,17)/t8-/m1/s1
C12H16N2O4252.26642200
5328154

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H16N2O4/c1-3-18-10-6-4-9(5-7-10)14-12(17)13-8(2)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)(H2,13,14,17)/p-1/t8-/m0/s1
C12H15N2O4251.25851100

Advertisement