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: IBVJFULICYLKCE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
152978

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5+,6+,7+/m0/s1
C8H17NO5S2271.3543182000
4037

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)
C8H17NO5S2271.35436300
5415761

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5-,6-,7-/m1/s1
C8H17NO5S2271.35432100
7992658

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5+,6-,7-/m1/s1
C8H17NO5S2271.35432100
62658450

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5+,6+,7+/m1/s1
C8H17NO5S2271.35432200
5415757

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5+,6-,7+/m0/s1
C8H17NO5S2271.35432100
5415759

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5-,6+,7-/m1/s1
C8H17NO5S2271.35432100
5415760

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/p-1/t4-,5-,6-,7-/m1/s1
C8H16NO5S2270.34691100
5415758

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/p-1/t4-,5-,6+,7-/m1/s1
C8H16NO5S2270.34691100
2015315

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/p-1
C8H16NO5S2270.346341100
5408794

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/p-1/t4-,5+,6+,7+/m0/s1
C8H16NO5S2270.34691100
5415756

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/p-1/t4-,5+,6-,7+/m0/s1
C8H16NO5S2270.34691100
67157807

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C8H17NO5S2/c1-9(8(15)16)2-4(11)6(13)7(14)5(12)3-10/h4-7,10-14H,2-3H2,1H3,(H,15,16)/t4-,5+,6+,7+/m0/s1/i1D
C8H16DNO5S2272.36041100

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