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: CFXUYLZMHCGZFJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17462331

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/t16-,17?,19-,21-/m1/s1
C22H33NO4375.501711900
3830520

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3
C22H33NO4375.50174300
5029448

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/t16-,17-,19-,21-/m1/s1
C22H33NO4375.50173100
1397022

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/t16-,17+,19-,21+/m1/s1
C22H33NO4375.50172100
1397021

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/p+1/t16-,17+,19-,21+/m1/s1
C22H34NO4376.50911100
5029447

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/p+1/t16-,17-,19-,21-/m1/s1
C22H34NO4376.50911100

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