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: RWNLJHDVRNBWFB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2223275

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3
C21H27N3O3369.45738261600
933785

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3/t18-/m1/s1
C21H27N3O3369.45742100
933786

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3/t18-/m0/s1
C21H27N3O3369.45742100
3427373

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3/p+1
C21H28N3O3370.465321100
5337245

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3/p+2/t18-/m1/s1
C21H29N3O3371.47221100
5337246

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27N3O3/c1-2-20(26)17-6-8-19(9-7-17)27-16-18(25)15-23-11-13-24(14-12-23)21-5-3-4-10-22-21/h3-10,18,25H,2,11-16H2,1H3/p+2/t18-/m0/s1
C21H29N3O3371.47221100

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