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: TYUQOEUNCZTNER (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10013595

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H28N2O5S/c23-19(17-8-4-5-9-18(17)20(24)25)21-14-10-12-16(13-11-14)28(26,27)22-15-6-2-1-3-7-15/h10-13,15,17-18,22H,1-9H2,(H,21,23)(H,24,25)/t17-,18+/m1/s1
C20H28N2O5S408.511717900
20736174

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C20H28N2O5S/c23-19(17-8-4-5-9-18(17)20(24)25)21-14-10-12-16(13-11-14)28(26,27)22-15-6-2-1-3-7-15/h10-13,15,17-18,22H,1-9H2,(H,21,23)(H,24,25)/t17?,18-/m0/s1
C20H28N2O5S408.51179700
2807405

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H28N2O5S/c23-19(17-8-4-5-9-18(17)20(24)25)21-14-10-12-16(13-11-14)28(26,27)22-15-6-2-1-3-7-15/h10-13,15,17-18,22H,1-9H2,(H,21,23)(H,24,25)
C20H28N2O5S408.511728500
10070397

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H28N2O5S/c23-19(17-8-4-5-9-18(17)20(24)25)21-14-10-12-16(13-11-14)28(26,27)22-15-6-2-1-3-7-15/h10-13,15,17-18,22H,1-9H2,(H,21,23)(H,24,25)/p-1/t17-,18+/m1/s1
C20H27N2O5S407.50431100

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