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: HMJSYXIPNSASJY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
19485798

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7-,8+,9+/m0/s1
C11H13N3O4251.2386323200
58782620

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7?,8-,9-/m1/s1
C11H13N3O4251.23865400
111311138

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7-,8+,9+/m1/s1
C11H13N3O4251.23861100
111311591

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7?,8-,9-/m0/s1
C11H13N3O4251.23861100
128925078

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7-,8-,9-/m1/s1
C11H13N3O4251.23861100
30650417

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H13N3O4/c1-2-6-4-14(11(17)13-10(6)12)9-3-7(16)8(5-15)18-9/h1,4,7-9,15-16H,3,5H2,(H2,12,13,17)/t7-,8?,9+/m0/s1
C11H13N3O4251.23861100

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