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 5 results

Search term: GTCQGPQDRGTCKI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2248367

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24N4O2/c1-15-11-20(27)25-19-8-4-3-7-18(19)24(21(25)17(15)12-22)14-16(26)13-23-9-5-2-6-10-23/h3-4,7-8,11,16,26H,2,5-6,9-10,13-14H2,1H3
C21H24N4O2364.44086231600
1606859

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O2/c1-15-11-20(27)25-19-8-4-3-7-18(19)24(21(25)17(15)12-22)14-16(26)13-23-9-5-2-6-10-23/h3-4,7-8,11,16,26H,2,5-6,9-10,13-14H2,1H3/t16-/m1/s1
C21H24N4O2364.44092100
1606861

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O2/c1-15-11-20(27)25-19-8-4-3-7-18(19)24(21(25)17(15)12-22)14-16(26)13-23-9-5-2-6-10-23/h3-4,7-8,11,16,26H,2,5-6,9-10,13-14H2,1H3/t16-/m0/s1
C21H24N4O2364.44092100
1606858

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O2/c1-15-11-20(27)25-19-8-4-3-7-18(19)24(21(25)17(15)12-22)14-16(26)13-23-9-5-2-6-10-23/h3-4,7-8,11,16,26H,2,5-6,9-10,13-14H2,1H3/p+1/t16-/m1/s1
C21H25N4O2365.44831100
1606860

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O2/c1-15-11-20(27)25-19-8-4-3-7-18(19)24(21(25)17(15)12-22)14-16(26)13-23-9-5-2-6-10-23/h3-4,7-8,11,16,26H,2,5-6,9-10,13-14H2,1H3/p+1/t16-/m0/s1
C21H25N4O2365.44831100

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