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: HMGQEVPWWCQOBY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
11014107

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C18H25N3O2/c19-18(23)20-17(22)16(14-7-2-1-3-8-14)21-11-10-13-6-4-5-9-15(13)12-21/h1-3,7-8,13,15-16H,4-6,9-12H2,(H3,19,20,22,23)
C18H25N3O2315.415200
10106145

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C18H25N3O2/c19-18(23)20-17(22)16(14-7-2-1-3-8-14)21-11-10-13-6-4-5-9-15(13)12-21/h1-3,7-8,13,15-16H,4-6,9-12H2,(H3,19,20,22,23)/t13-,15+,16-/m0/s1
C18H25N3O2315.413200
10106147

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C18H25N3O2/c19-18(23)20-17(22)16(14-7-2-1-3-8-14)21-11-10-13-6-4-5-9-15(13)12-21/h1-3,7-8,13,15-16H,4-6,9-12H2,(H3,19,20,22,23)/t13-,15+,16+/m0/s1
C18H25N3O2315.412100
10106144

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C18H25N3O2/c19-18(23)20-17(22)16(14-7-2-1-3-8-14)21-11-10-13-6-4-5-9-15(13)12-21/h1-3,7-8,13,15-16H,4-6,9-12H2,(H3,19,20,22,23)/p+1/t13-,15+,16-/m0/s1
C18H26N3O2316.41741100
10106146

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C18H25N3O2/c19-18(23)20-17(22)16(14-7-2-1-3-8-14)21-11-10-13-6-4-5-9-15(13)12-21/h1-3,7-8,13,15-16H,4-6,9-12H2,(H3,19,20,22,23)/p+1/t13-,15+,16+/m0/s1
C18H26N3O2316.41741100

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