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: COEQIRLCQCRSGI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3557696

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C33H33N3O/c1-35(2)23-29-31(25-15-7-3-8-16-25)30(33(37)27-19-11-5-12-20-27)24-36(34-28-21-13-6-14-22-28)32(29)26-17-9-4-10-18-26/h3-22,30-31,34H,23-24H2,1-2H3
C33H33N3O487.6346213800
62646517

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C33H33N3O/c1-35(2)23-29-31(25-15-7-3-8-16-25)30(33(37)27-19-11-5-12-20-27)24-36(34-28-21-13-6-14-22-28)32(29)26-17-9-4-10-18-26/h3-22,30-31,34H,23-24H2,1-2H3/t30-,31-/m1/s1
C33H33N3O487.63462200
1460891

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C33H33N3O/c1-35(2)23-29-31(25-15-7-3-8-16-25)30(33(37)27-19-11-5-12-20-27)24-36(34-28-21-13-6-14-22-28)32(29)26-17-9-4-10-18-26/h3-22,30-31,34H,23-24H2,1-2H3/t30-,31-/m0/s1
C33H33N3O487.63462100
1460890

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C33H33N3O/c1-35(2)23-29-31(25-15-7-3-8-16-25)30(33(37)27-19-11-5-12-20-27)24-36(34-28-21-13-6-14-22-28)32(29)26-17-9-4-10-18-26/h3-22,30-31,34H,23-24H2,1-2H3/p+1/t30-,31-/m0/s1
C33H34N3O488.6421100

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