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 3 results

Search term: PDYPPHFTDANIHK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1404908

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O5/c1-9(2)7-12(14(22)17-8-13(20)21)19-15(23)10-5-3-4-6-11(10)18-16(19)24/h3-6,9,12H,7-8H2,1-2H3,(H,17,22)(H,18,24)(H,20,21)/p-1/t12-/m0/s1
C16H18N3O5332.33182200
1404909

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H19N3O5/c1-9(2)7-12(14(22)17-8-13(20)21)19-15(23)10-5-3-4-6-11(10)18-16(19)24/h3-6,9,12H,7-8H2,1-2H3,(H,17,22)(H,18,24)(H,20,21)/t12-/m0/s1
C16H19N3O5333.33922100
4022525

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H19N3O5/c1-9(2)7-12(14(22)17-8-13(20)21)19-15(23)10-5-3-4-6-11(10)18-16(19)24/h3-6,9,12H,7-8H2,1-2H3,(H,17,22)(H,18,24)(H,20,21)
C16H19N3O5333.339162100

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