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 9 results

Search term: QVMPHRHVMPNHQF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2010111

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3
C17H27N245.402987300
5532161

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/t14-,16-,17-/m1/s1
C17H27N245.4032100
5532163

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/t14-,16+,17+/m0/s1
C17H27N245.4032100
5532165

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/t14-,16+,17-/m1/s1
C17H27N245.4032100
5532167

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/t14-,16-,17+/m0/s1
C17H27N245.4032100
5532166

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/p+1/t14-,16-,17+/m0/s1
C17H28N246.41041100
5532164

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/p+1/t14-,16+,17-/m1/s1
C17H28N246.41041100
5532162

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/p+1/t14-,16+,17+/m0/s1
C17H28N246.41041100
5532160

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H27N/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/p+1/t14-,16-,17-/m1/s1
C17H28N246.41041100

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