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 3 results

Search term: PKHJGHLROMYTSB-KDUYIZSRCE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23017187

Double-bond stereo
InChI=1/C29H30ClN3O2S/c1-21(2)32(19-23-8-4-3-5-9-23)17-16-31-28(34)20-33-25-10-6-7-11-26(25)36-27(29(33)35)18-22-12-14-24(30)15-13-22/h3-15,18,21H,16-17,19-20H2,1-2H3,(H,31,34)/b27-18-
C29H30ClN3O2S520.08548700
3343329

Double-bond stereo
InChI=1/C29H30ClN3O2S/c1-21(2)32(19-23-8-4-3-5-9-23)17-16-31-28(34)20-33-25-10-6-7-11-26(25)36-27(29(33)35)18-22-12-14-24(30)15-13-22/h3-15,18,21H,16-17,19-20H2,1-2H3,(H,31,34)
C29H30ClN3O2S520.08543200
3343328

Charge

Double-bond stereo
InChI=1/C29H30ClN3O2S/c1-21(2)32(19-23-8-4-3-5-9-23)17-16-31-28(34)20-33-25-10-6-7-11-26(25)36-27(29(33)35)18-22-12-14-24(30)15-13-22/h3-15,18,21H,16-17,19-20H2,1-2H3,(H,31,34)/p+1
C29H31ClN3O2S521.093341100

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