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: MMSXRWNFSXWXPU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
501200

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)
C16H21N3O2287.3568221600
1072522

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/t10-,11-,13+,16+/m1/s1
C16H21N3O2287.35682100
5425929

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/t10-,11+,13+,16-/m1/s1
C16H21N3O2287.35682100
5425931

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/t10-,11-,13-,16+/m0/s1
C16H21N3O2287.35682100
5425930

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/p+1/t10-,11-,13-,16+/m0/s1
C16H22N3O2288.36421100
5348966

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/p+1/t10-,11-,13+,16+/m1/s1
C16H22N3O2288.36421100
5425928

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H21N3O2/c1-10-9-19(3)13(12-7-5-4-6-8-12)11(2)16(10)14(20)17-15(21)18-16/h4-8,10-11,13H,9H2,1-3H3,(H2,17,18,20,21)/p+1/t10-,11+,13+,16-/m1/s1
C16H22N3O2288.36421100

Advertisement