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 3 results

Search term: XNBGMEGJUYHLRB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
142159

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H20N2O10/c1-8(27)34-22-17-15(21(33)23(35-9(2)28)24(22,4)36-10(3)29)14-16(18(17)26-25)20(32)13-11(19(14)31)6-5-7-12(13)30/h5-7,21-23,33H,1-4H3,(H-,30,31,32)/t21-,22+,23+,24+/m0/s1
C24H20N2O10496.4234400
142160

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H20N2O10/c1-8(27)34-22-17-15(21(33)23(35-9(2)28)24(22,4)36-10(3)29)14-16(18(17)26-25)20(32)13-11(19(14)31)6-5-7-12(13)30/h5-7,21-23,33H,1-4H3,(H-,30,31,32)/p+1/t21-,22+,23+,24+/m0/s1
C24H21N2O10497.43043200
28560027

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C24H20N2O10/c1-8(27)34-22-17-15(21(33)23(35-9(2)28)24(22,4)36-10(3)29)14-16(18(17)26-25)20(32)13-11(19(14)31)6-5-7-12(13)30/h5-7,21-23,33H,1-4H3,(H-,30,31,32)
C24H20N2O10496.4232100

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