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 8 results

Search term: IKXILDNPCZPPRV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5789

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13+,14+,15+,16+,18+,19+,20+/m1/s1
C20H32O2304.4669506500
21828417

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13+,14?,15?,16?,18?,19+,20+/m1/s1
C20H32O2304.46694200
58783830

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13+,14+,15+,16+,18+,19+,20+/m1/s1/i1D3
C20H29D3O2307.48543300
16740576

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13?,14+,15+,16+,18+,19+,20+/m1/s1
C20H32O2304.46692280
11803237

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13?,14?,15?,16?,18+,19+,20+/m1/s1
C20H32O2304.46691100
58817739

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12-,13+,14+,15+,16+,18+,19?,20?/m1/s1
C20H32O2304.46691100
95601082

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12?,13-,14-,15-,16-,18-,19-,20-/m0/s1
C20H32O2304.46691100
95601083

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C20H32O2/c1-12-11-20(3)13(10-17(12)21)4-5-14-15-6-7-18(22)19(15,2)9-8-16(14)20/h12-16,18,22H,4-11H2,1-3H3/t12?,13-,14+,15-,16-,18-,19-,20-/m0/s1
C20H32O2304.46691100

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