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: AUCNBBXCSKXRCT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2064014

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3
C20H26N2O2S358.49764261900
5338414

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3/p+1/t20-/m0/s1
C20H27N2O2S359.5052200
940239

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3/t20-/m0/s1
C20H26N2O2S358.49762100
940240

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3/t20-/m1/s1
C20H26N2O2S358.49762100
5338415

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3/p+1/t20-/m1/s1
C20H27N2O2S359.5051100
95755640

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H26N2O2S/c1-17-10-12-19(13-11-17)25(23,24)21-16-20(18-8-4-2-5-9-18)22-14-6-3-7-15-22/h2,4-5,8-13,20-21H,3,6-7,14-16H2,1H3/p+1
C20H27N2O2S359.5051100

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