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 6 results

Search term: C41H79NO3 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
98150

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C41H79NO3/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-42-41(6-3,37-44-39)38-45-40(43)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h4-38H2,1-3H3
C41H79NO3634.0709121300
64808489

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C41H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h8,10,34,36,39-40,43-44H,3-7,9,11-33,35,37-38H2,1-2H3,(H,42,45)/b10-8-,36-34+/t39-,40+/m0/s1
C41H79NO3634.07093400
78315788

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C41H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-40(44)39(38-43)42-41(45)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h26,28,34,36,39-40,43-44H,3-25,27,29-33,35,37-38H2,1-2H3,(H,42,45)/b28-26+,36-34+/t39-,40+/m0/s1
C41H79NO3634.07093300
98645165

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C41H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h17-18,34,36,39-40,43-44H,3-16,19-33,35,37-38H2,1-2H3,(H,42,45)/b18-17-,36-34+/t39-,40+/m0/s1
C41H79NO3634.07092200
123960373

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C41H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h17-18,34,36,39-40,43-44H,3-16,19-33,35,37-38H2,1-2H3,(H,42,45)/b18-17+,36-34+
C41H79NO3634.07091100
95750902

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C41H79NO3/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-42-41(6-3,37-44-39)38-45-40(43)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h36,43H,4-35,37-38H2,1-3H3
C41H79NO3634.07091100

Advertisement