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 6 results

Search term: YGPUHVDSYCFKQV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2110290

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3
C22H25N3O3379.4522281800
949999

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3/t20-/m1/s1
C22H25N3O3379.45222100
950000

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3/t20-/m0/s1
C22H25N3O3379.45222100
2871303

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3/p+2
C22H27N3O3381.468081100
5339458

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3/p+2/t20-/m1/s1
C22H27N3O3381.4671100
5339459

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H25N3O3/c1-28-19-9-7-18(8-10-19)25-21(26)15-20(22(25)27)24-13-11-23(12-14-24)16-17-5-3-2-4-6-17/h2-10,20H,11-16H2,1H3/p+2/t20-/m0/s1
C22H27N3O3381.4671100

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