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: HXMSDOJSDNSAQR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9729395

Double-bond stereo
InChI=1/C19H23N7O2.C3H6O3/c27-19(21-13-2-3-13)24-16-10-20-25-17(16)18-22-14-4-1-12(9-15(14)23-18)11-26-5-7-28-8-6-26;1-2(4)3(5)6/h1,4,9-10,13,20,25H,2-3,5-8,11H2,(H2,21,24,27);2,4H,1H3,(H,5,6)/b18-17+;
C22H29N7O5471.50962200
35143206

Double-bond stereo
InChI=1/C19H23N7O2.C3H6O3/c27-19(21-13-2-3-13)24-16-10-20-25-17(16)18-22-14-4-1-12(9-15(14)23-18)11-26-5-7-28-8-6-26;1-2(4)3(5)6/h1,4,9-10,13,20,25H,2-3,5-8,11H2,(H2,21,24,27);2,4H,1H3,(H,5,6)/b18-17-;
C22H29N7O5471.50962100
57569404

Double-bond stereo
InChI=1/C19H23N7O2.C3H6O3/c27-19(21-13-2-3-13)24-16-10-20-25-17(16)18-22-14-4-1-12(9-15(14)23-18)11-26-5-7-28-8-6-26;1-2(4)3(5)6/h1,4,9-10,13,20,25H,2-3,5-8,11H2,(H2,21,24,27);2,4H,1H3,(H,5,6)/b18-17+;/t;2-/m.0/s1
C22H29N7O5471.50961100
9887258

Double-bond stereo
InChI=1/C19H23N7O2.C3H6O3/c27-19(21-13-2-3-13)24-16-10-20-25-17(16)18-22-14-4-1-12(9-15(14)23-18)11-26-5-7-28-8-6-26;1-2(4)3(5)6/h1,4,9-10,13,20,25H,2-3,5-8,11H2,(H2,21,24,27);2,4H,1H3,(H,5,6)/b18-17+;/t;2-/m.1/s1
C22H29N7O5471.50961100

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