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: CJJOLVPFUXNOHV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2357739

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C20H31N3O4/c1-6-13(2)16(23-19(26)27-20(3,4)5)18(25)22-15(17(21)24)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H2,21,24)(H,22,25)(H,23,26)
C20H31N3O4377.4778413600
5393699

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C20H31N3O4/c1-6-13(2)16(23-19(26)27-20(3,4)5)18(25)22-15(17(21)24)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H2,21,24)(H,22,25)(H,23,26)/t13-,15-,16-/m0/s1
C20H31N3O4377.47783200
5442993

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C20H31N3O4/c1-6-13(2)16(23-19(26)27-20(3,4)5)18(25)22-15(17(21)24)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H2,21,24)(H,22,25)(H,23,26)/t13-,15+,16+/m1/s1
C20H31N3O4377.47782100
5442996

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C20H31N3O4/c1-6-13(2)16(23-19(26)27-20(3,4)5)18(25)22-15(17(21)24)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H2,21,24)(H,22,25)(H,23,26)/t13-,15+,16-/m1/s1
C20H31N3O4377.47782100
5442998

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C20H31N3O4/c1-6-13(2)16(23-19(26)27-20(3,4)5)18(25)22-15(17(21)24)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H2,21,24)(H,22,25)(H,23,26)/t13-,15-,16+/m0/s1
C20H31N3O4377.47782100

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