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: ISCATKGXTNHYCZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3473485

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C28H50N2O2/c1-27(2)18-24(30-26(32)17-15-23-12-8-5-9-13-23)19-28(3,20-27)21-29-25(31)16-14-22-10-6-4-7-11-22/h22-24H,4-21H2,1-3H3,(H,29,31)(H,30,32)
C28H50N2O2446.708800000001211600
5330642

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H50N2O2/c1-27(2)18-24(30-26(32)17-15-23-12-8-5-9-13-23)19-28(3,20-27)21-29-25(31)16-14-22-10-6-4-7-11-22/h22-24H,4-21H2,1-3H3,(H,29,31)(H,30,32)/t24-,28+/m1/s1
C28H50N2O2446.7088000000012100
5330643

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H50N2O2/c1-27(2)18-24(30-26(32)17-15-23-12-8-5-9-13-23)19-28(3,20-27)21-29-25(31)16-14-22-10-6-4-7-11-22/h22-24H,4-21H2,1-3H3,(H,29,31)(H,30,32)/t24-,28-/m1/s1
C28H50N2O2446.7088000000012100
5330644

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H50N2O2/c1-27(2)18-24(30-26(32)17-15-23-12-8-5-9-13-23)19-28(3,20-27)21-29-25(31)16-14-22-10-6-4-7-11-22/h22-24H,4-21H2,1-3H3,(H,29,31)(H,30,32)/t24-,28-/m0/s1
C28H50N2O2446.7088000000012100
5330645

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H50N2O2/c1-27(2)18-24(30-26(32)17-15-23-12-8-5-9-13-23)19-28(3,20-27)21-29-25(31)16-14-22-10-6-4-7-11-22/h22-24H,4-21H2,1-3H3,(H,29,31)(H,30,32)/t24-,28+/m0/s1
C28H50N2O2446.7088000000012100

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