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 5 results

Search term: IBCXQWACMNKPCL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3409569

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H23NO7/c1-23-8-7-11-9-14-19(29-10-28-14)21(27-4)15(11)17(23)20-16-12(22(24)30-20)5-6-13(25-2)18(16)26-3/h5-6,9,17,20H,7-8,10H2,1-4H3
C22H23NO7413.42052181300
5454392

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO7/c1-23-8-7-11-9-14-19(29-10-28-14)21(27-4)15(11)17(23)20-16-12(22(24)30-20)5-6-13(25-2)18(16)26-3/h5-6,9,17,20H,7-8,10H2,1-4H3/t17-,20+/m1/s1
C22H23NO7413.42054200
5454390

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO7/c1-23-8-7-11-9-14-19(29-10-28-14)21(27-4)15(11)17(23)20-16-12(22(24)30-20)5-6-13(25-2)18(16)26-3/h5-6,9,17,20H,7-8,10H2,1-4H3/t17-,20-/m0/s1
C22H23NO7413.42052100
5454391

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO7/c1-23-8-7-11-9-14-19(29-10-28-14)21(27-4)15(11)17(23)20-16-12(22(24)30-20)5-6-13(25-2)18(16)26-3/h5-6,9,17,20H,7-8,10H2,1-4H3/p+1/t17-,20+/m1/s1
C22H24NO7414.42791100
5454389

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H23NO7/c1-23-8-7-11-9-14-19(29-10-28-14)21(27-4)15(11)17(23)20-16-12(22(24)30-20)5-6-13(25-2)18(16)26-3/h5-6,9,17,20H,7-8,10H2,1-4H3/p+1/t17-,20-/m0/s1
C22H24NO7414.42791100

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