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 7 results

Search term: JXQDEIWMSFDOLN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2151906

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3
C21H24N4O3380.44026221700
900176

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/t18-/m1/s1
C21H24N4O3380.44032100
900177

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/t18-/m0/s1
C21H24N4O3380.44032100
3938519

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/p+1
C21H25N4O3381.44771100
3938520

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/p+2
C21H26N4O3382.4551100
5332931

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/p+2/t18-/m1/s1
C21H26N4O3382.456141100
5332932

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24N4O3/c1-2-28-17-8-6-16(7-9-17)25-20(26)15-18(21(25)27)23-11-13-24(14-12-23)19-5-3-4-10-22-19/h3-10,18H,2,11-15H2,1H3/p+2/t18-/m0/s1
C21H26N4O3382.456141100

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