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: YMLJFLMDGZKPQP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5446160

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H24N4O5/c1-10(2)8-13(16(24)19-11(3)17(25)26)21-18(27)22-9-15(23)20-12-6-4-5-7-14(12)22/h4-7,10-11,13H,8-9H2,1-3H3,(H,19,24)(H,20,23)(H,21,27)(H,25,26)/t11-,13+/m1/s1
C18H24N4O5376.407131000
5446228

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H24N4O5/c1-10(2)8-13(16(24)19-11(3)17(25)26)21-18(27)22-9-15(23)20-12-6-4-5-7-14(12)22/h4-7,10-11,13H,8-9H2,1-3H3,(H,19,24)(H,20,23)(H,21,27)(H,25,26)/t11-,13-/m0/s1
C18H24N4O5376.40710800
109852901

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H24N4O5/c1-10(2)8-13(16(24)19-11(3)17(25)26)21-18(27)22-9-15(23)20-12-6-4-5-7-14(12)22/h4-7,10-11,13H,8-9H2,1-3H3,(H,19,24)(H,20,23)(H,21,27)(H,25,26)
C18H24N4O5376.4071100
5446227

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H24N4O5/c1-10(2)8-13(16(24)19-11(3)17(25)26)21-18(27)22-9-15(23)20-12-6-4-5-7-14(12)22/h4-7,10-11,13H,8-9H2,1-3H3,(H,19,24)(H,20,23)(H,21,27)(H,25,26)/p-1/t11-,13-/m0/s1
C18H23N4O5375.39961100
5446159

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H24N4O5/c1-10(2)8-13(16(24)19-11(3)17(25)26)21-18(27)22-9-15(23)20-12-6-4-5-7-14(12)22/h4-7,10-11,13H,8-9H2,1-3H3,(H,19,24)(H,20,23)(H,21,27)(H,25,26)/p-1/t11-,13+/m1/s1
C18H23N4O5375.39961100

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