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 4 results

Search term: YPSDUJLVLCITNC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
143003

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H18N4O7/c18-6-10-12(20)13(21)11(19)9(24-10)5-14-16-15-7-1-3-8(4-2-7)17(22)23/h1-4,9-13,18-21H,5-6H2,(H,14,15)
C13H18N4O7342.304641600
19989524

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18N4O7/c18-6-10-12(20)13(21)11(19)9(24-10)5-14-16-15-7-1-3-8(4-2-7)17(22)23/h1-4,9-13,18-21H,5-6H2,(H,14,15)/t9-,10+,11-,12-,13+/m0/s1
C13H18N4O7342.30462200
19989525

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C13H18N4O7/c18-6-10-12(20)13(21)11(19)9(24-10)5-14-16-15-7-1-3-8(4-2-7)17(22)23/h1-4,9-13,18-21H,5-6H2,(H,14,15)/t9-,10+,11-,12+,13+/m0/s1
C13H18N4O7342.30461100
20143827

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H18N4O7/c18-6-10-12(20)13(21)11(19)9(24-10)5-14-16-15-7-1-3-8(4-2-7)17(22)23/h1-4,9-13,18-21H,5-6H2,(H,14,15)/t9?,10-,11-,12-,13-/m1/s1
C13H18N4O7342.30461100

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