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: LAIOPTKSQBPSHG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1034

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H13N5O3/c13-12-16-10-8(11(20)17-12)5(4-15-10)3-14-6-1-2-7(18)9(6)19/h1-2,4,6-7,9,14,18-19H,3H2,(H2,13,17,20)
C12H13N5O3275.263348700
21211627

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H13N5O3/c13-12-16-10-8(11(20)17-12)5(4-15-10)3-14-6-1-2-7(18)9(6)19/h1-2,4,6-7,9,14,18-19H,3H2,(H2,13,17,20)/p+1/t6-,7+,9+/m1/s1
C12H14N5O3276.27071100
24816787

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C12H13N5O3/c13-12-16-10-8(11(20)17-12)5(4-15-10)3-14-6-1-2-7(18)9(6)19/h1-2,4,6-7,9,14,18-19H,3H2,(H2,13,17,20)/p+1
C12H14N5O3276.27071100

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