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 5 results

Search term: WJNJQDQWGRQWCD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2197242

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)
C27H21N3O2419.47454211300
1719424

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)/t25-/m0/s1
C27H21N3O2419.47452100
1719425

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)/t25-/m1/s1
C27H21N3O2419.47452100
5393510

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)/p+1/t25-/m0/s1
C27H22N3O2420.48191100
5393511

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)/p+1/t25-/m1/s1
C27H22N3O2420.48191100

Advertisement