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: HBHUWTINICXQSH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3076859

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H27N3O3/c1-10-7-6-8-16(4,5)14(10)13(21)9-11(2)19(12(3)20)18-15(17)22/h6-7,10-11,14H,8-9H2,1-5H3,(H3,17,18,22)
C16H27N3O3309.403915800
5030684

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H27N3O3/c1-10-7-6-8-16(4,5)14(10)13(21)9-11(2)19(12(3)20)18-15(17)22/h6-7,10-11,14H,8-9H2,1-5H3,(H3,17,18,22)/t10-,11+,14-/m0/s1
C16H27N3O3309.40393200
5371548

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H27N3O3/c1-10-7-6-8-16(4,5)14(10)13(21)9-11(2)19(12(3)20)18-15(17)22/h6-7,10-11,14H,8-9H2,1-5H3,(H3,17,18,22)/t10-,11-,14+/m1/s1
C16H27N3O3309.40392100
5631011

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H27N3O3/c1-10-7-6-8-16(4,5)14(10)13(21)9-11(2)19(12(3)20)18-15(17)22/h6-7,10-11,14H,8-9H2,1-5H3,(H3,17,18,22)/t10-,11+,14+/m0/s1
C16H27N3O3309.40392100
1478101

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H27N3O3/c1-10-7-6-8-16(4,5)14(10)13(21)9-11(2)19(12(3)20)18-15(17)22/h6-7,10-11,14H,8-9H2,1-5H3,(H3,17,18,22)/t10-,11-,14-/m1/s1
C16H27N3O3309.40392100

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