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: YHQRMTZJCXIMPY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
522415

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H20FN3O3/c21-14-1-5-17(6-2-14)24-19(25)13-18(20(24)26)22-15-3-7-16(8-4-15)23-9-11-27-12-10-23/h1-8,18,22H,9-13H2
C20H20FN3O3369.3895282200
851908

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H20FN3O3/c21-14-1-5-17(6-2-14)24-19(25)13-18(20(24)26)22-15-3-7-16(8-4-15)23-9-11-27-12-10-23/h1-8,18,22H,9-13H2/t18-/m1/s1
C20H20FN3O3369.38953200
851907

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H20FN3O3/c21-14-1-5-17(6-2-14)24-19(25)13-18(20(24)26)22-15-3-7-16(8-4-15)23-9-11-27-12-10-23/h1-8,18,22H,9-13H2/t18-/m0/s1
C20H20FN3O3369.38952100
21205593

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H20FN3O3/c21-14-1-5-17(6-2-14)24-19(25)13-18(20(24)26)22-15-3-7-16(8-4-15)23-9-11-27-12-10-23/h1-8,18,22H,9-13H2/p+2/t18-/m1/s1
C20H22FN3O3371.40431100
21205594

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H20FN3O3/c21-14-1-5-17(6-2-14)24-19(25)13-18(20(24)26)22-15-3-7-16(8-4-15)23-9-11-27-12-10-23/h1-8,18,22H,9-13H2/p+1/t18-/m1/s1
C20H21FN3O3370.39691200

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