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 8 results

Search term: UEFRDQSMQXDWTO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28540388

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3
C11H21NO5247.28816600
35032578

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8?,9-/m0/s1
C11H21NO5247.28815400
34999533

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8?,9-/m1/s1
C11H21NO5247.28814600
13088232

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9-/m1/s1
C11H21NO5247.28812200
13088233

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/p+1/t8-,9-/m1/s1
C11H22NO5248.29551100
58784241

1 of 2 defined stereocentres - 1/2 defined

Non-standard isotope
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8?,9-/m1/s1/i2D3
C11H18D3NO5250.30661100
115005834

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9+/m0/s1/i2D3
C11H18D3NO5250.30661100
128430671

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9+/m1/s1
C11H21NO5247.28811100

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