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: WTHUYMDQFRSUNJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2209526

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H27N3O4/c1-29-18-8-9-21(30-2)19(14-18)26-22(27)15-20(23(26)28)25-12-10-24(11-13-25)16-17-6-4-3-5-7-17/h3-9,14,20H,10-13,15-16H2,1-2H3
C23H27N3O4409.47818251600
921482

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H27N3O4/c1-29-18-8-9-21(30-2)19(14-18)26-22(27)15-20(23(26)28)25-12-10-24(11-13-25)16-17-6-4-3-5-7-17/h3-9,14,20H,10-13,15-16H2,1-2H3/t20-/m1/s1
C23H27N3O4409.47822100
921483

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H27N3O4/c1-29-18-8-9-21(30-2)19(14-18)26-22(27)15-20(23(26)28)25-12-10-24(11-13-25)16-17-6-4-3-5-7-17/h3-9,14,20H,10-13,15-16H2,1-2H3/t20-/m0/s1
C23H27N3O4409.47822100
5335495

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H27N3O4/c1-29-18-8-9-21(30-2)19(14-18)26-22(27)15-20(23(26)28)25-12-10-24(11-13-25)16-17-6-4-3-5-7-17/h3-9,14,20H,10-13,15-16H2,1-2H3/p+2/t20-/m1/s1
C23H29N3O4411.4931100
5335496

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H27N3O4/c1-29-18-8-9-21(30-2)19(14-18)26-22(27)15-20(23(26)28)25-12-10-24(11-13-25)16-17-6-4-3-5-7-17/h3-9,14,20H,10-13,15-16H2,1-2H3/p+2/t20-/m0/s1
C23H29N3O4411.4931100

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