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 9 results

Search term: XENZICQEFWMILM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
541482

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3
C21H33NO2331.4922221800
595334

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/t18-,21-/m0/s1
C21H33NO2331.49222100
1040132

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/t18-,21-/m1/s1
C21H33NO2331.49222100
5468824

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/t18-,21+/m0/s1
C21H33NO2331.49222100
5468827

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/t18-,21+/m1/s1
C21H33NO2331.49222100
5468825

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/p+1/t18-,21-/m1/s1
C21H34NO2332.49961100
5468826

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/p+1/t18-,21+/m1/s1
C21H34NO2332.49961100
5295929

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/p+1/t18-,21-/m0/s1
C21H34NO2332.500161100
5468823

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H33NO2/c1-16(23)24-21(17-11-9-8-10-12-17)13-18(19(2,3)4)14-22(15-21)20(5,6)7/h8-12,18H,13-15H2,1-7H3/p+1/t18-,21+/m0/s1
C21H34NO2332.49961100

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