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: IPOLUNCXWXXHAX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2112830

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H31NO/c1-2-21(14-7-8-15-21)22(24,20-12-5-3-6-13-20)16-11-19-23-17-9-4-10-18-23/h3,5-6,12-13,24H,2,4,7-10,14-15,17-19H2,1H3
C22H31NO325.48764191300
1155316

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H31NO/c1-2-21(14-7-8-15-21)22(24,20-12-5-3-6-13-20)16-11-19-23-17-9-4-10-18-23/h3,5-6,12-13,24H,2,4,7-10,14-15,17-19H2,1H3/t22-/m1/s1
C22H31NO325.48762100
1155317

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H31NO/c1-2-21(14-7-8-15-21)22(24,20-12-5-3-6-13-20)16-11-19-23-17-9-4-10-18-23/h3,5-6,12-13,24H,2,4,7-10,14-15,17-19H2,1H3/t22-/m0/s1
C22H31NO325.48762100
5352494

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H31NO/c1-2-21(14-7-8-15-21)22(24,20-12-5-3-6-13-20)16-11-19-23-17-9-4-10-18-23/h3,5-6,12-13,24H,2,4,7-10,14-15,17-19H2,1H3/p+1/t22-/m1/s1
C22H32NO326.4951100
5352495

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H31NO/c1-2-21(14-7-8-15-21)22(24,20-12-5-3-6-13-20)16-11-19-23-17-9-4-10-18-23/h3,5-6,12-13,24H,2,4,7-10,14-15,17-19H2,1H3/p+1/t22-/m0/s1
C22H32NO326.4951100

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