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 13 results

Search term: YCNCXQNUXCHRRX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24675897

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14+/m1/s1
C14H22N2OS266.4023222100
29394287

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11?,14?/m1/s1
C14H22N2OS266.402311700
72391275

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)
C14H22N2OS266.40238700
24662411

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14?/m1/s1
C14H22N2OS266.40233300
24662586

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14-/m0/s1
C14H22N2OS266.40233300
24663341

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14-/m1/s1
C14H22N2OS266.40233300
24673592

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14+/m0/s1
C14H22N2OS266.40233300
9674768

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14?/m0/s1
C14H22N2OS266.40232100
75561878

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9?,10?,11?,14-/m0/s1
C14H22N2OS266.40231100
114815228

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10-,11+,14+/m1/s1
C14H22N2OS266.40231100
114974163

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10-,11-,14-/m0/s1
C14H22N2OS266.40231100
58994870

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14+/m1/s1/i3+2
C1314CH22N2OS268.39481100
68025170

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10-,11-,14?/m1/s1
C14H22N2OS266.40231100

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