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: HVSILNVTAWKPSC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9948599

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30N4OS/c23-18(15-28)22(27)26-12-11-25-14-19(17-9-5-2-6-10-17)24-21(25)20(26)13-16-7-3-1-4-8-16/h2,5-6,9-10,14,16,18,20,28H,1,3-4,7-8,11-13,15,23H2/t18-,20-/m0/s1
C22H30N4OS398.564881000
7997971

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30N4OS/c23-18(15-28)22(27)26-12-11-25-14-19(17-9-5-2-6-10-17)24-21(25)20(26)13-16-7-3-1-4-8-16/h2,5-6,9-10,14,16,18,20,28H,1,3-4,7-8,11-13,15,23H2
C22H30N4OS398.56484300
9615792

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H30N4OS/c23-18(15-28)22(27)26-12-11-25-14-19(17-9-5-2-6-10-17)24-21(25)20(26)13-16-7-3-1-4-8-16/h2,5-6,9-10,14,16,18,20,28H,1,3-4,7-8,11-13,15,23H2/t18?,20-/m0/s1
C22H30N4OS398.56482100
8136219

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H30N4OS/c23-18(15-28)22(27)26-12-11-25-14-19(17-9-5-2-6-10-17)24-21(25)20(26)13-16-7-3-1-4-8-16/h2,5-6,9-10,14,16,18,20,28H,1,3-4,7-8,11-13,15,23H2/t18-,20?/m0/s1
C22H30N4OS398.56481100

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