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: PPWJWBNGFTXWOM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2219838

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H29NO3/c1-17(2)10-14(20)11-18(3,4)19(17)12-15(21)13-22-16-8-6-5-7-9-16/h5-9,14-15,20-21H,10-13H2,1-4H3
C18H29NO3307.42776171200
844993

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H29NO3/c1-17(2)10-14(20)11-18(3,4)19(17)12-15(21)13-22-16-8-6-5-7-9-16/h5-9,14-15,20-21H,10-13H2,1-4H3/t15-/m0/s1
C18H29NO3307.42782100
844994

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H29NO3/c1-17(2)10-14(20)11-18(3,4)19(17)12-15(21)13-22-16-8-6-5-7-9-16/h5-9,14-15,20-21H,10-13H2,1-4H3/t15-/m1/s1
C18H29NO3307.42782100
5768302

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H29NO3/c1-17(2)10-14(20)11-18(3,4)19(17)12-15(21)13-22-16-8-6-5-7-9-16/h5-9,14-15,20-21H,10-13H2,1-4H3/p+1/t15-/m0/s1
C18H30NO3308.43521100
5768303

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H29NO3/c1-17(2)10-14(20)11-18(3,4)19(17)12-15(21)13-22-16-8-6-5-7-9-16/h5-9,14-15,20-21H,10-13H2,1-4H3/p+1/t15-/m1/s1
C18H30NO3308.43521100

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