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 13 results

Search term: LLHOYOCAAURYRL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2006885

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6+/m1/s1
C9H17NO5219.234981037800
5360671

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6+/m0/s1
C9H17NO5219.235674000
5360668

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6-/m0/s1
C9H17NO5219.235563900
90472

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)
C9H17NO5219.235444600
5360673

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6-/m1/s1
C9H17NO5219.235312200
2011821

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5?,6-/m0/s1
C9H17NO5219.23498281400
27473636

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6?/m0/s1
C9H17NO5219.23513700
21242807

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5?,6-/m1/s1
C9H17NO5219.2359500
5360672

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/p-1/t5-,6-/m1/s1
C9H16NO5218.22761100
5360667

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/p-1/t5-,6-/m0/s1
C9H16NO5218.22761100
5360669

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/p-1/t5-,6+/m1/s1
C9H16NO5218.22761100
5360670

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/p-1/t5-,6+/m0/s1
C9H16NO5218.22761100

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