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: UAFQQJVDGPMBPO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8746602

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H30N4O2/c1-17-7-2-3-8-18(17)23-15-13-22(14-16-23)10-6-12-25-20(26)19-9-4-5-11-24(19)21(25)27/h2-3,7-8,19H,4-6,9-16H2,1H3
C21H30N4O2370.4885161100
854327

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H30N4O2/c1-17-7-2-3-8-18(17)23-15-13-22(14-16-23)10-6-12-25-20(26)19-9-4-5-11-24(19)21(25)27/h2-3,7-8,19H,4-6,9-16H2,1H3/t19-/m1/s1
C21H30N4O2370.48852100
854328

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H30N4O2/c1-17-7-2-3-8-18(17)23-15-13-22(14-16-23)10-6-12-25-20(26)19-9-4-5-11-24(19)21(25)27/h2-3,7-8,19H,4-6,9-16H2,1H3/t19-/m0/s1
C21H30N4O2370.48852100
5330125

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H30N4O2/c1-17-7-2-3-8-18(17)23-15-13-22(14-16-23)10-6-12-25-20(26)19-9-4-5-11-24(19)21(25)27/h2-3,7-8,19H,4-6,9-16H2,1H3/p+1/t19-/m1/s1
C21H31N4O2371.496441100
5330126

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H30N4O2/c1-17-7-2-3-8-18(17)23-15-13-22(14-16-23)10-6-12-25-20(26)19-9-4-5-11-24(19)21(25)27/h2-3,7-8,19H,4-6,9-16H2,1H3/p+1/t19-/m0/s1
C21H31N4O2371.496441100

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