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 6 results

Search term: MFJVYXLNZAGCGM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2103205

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)
C18H16N2O2S324.39684482800
585330

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)/t12-/m0/s1
C18H16N2O2S324.39683100
585331

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)/t12-/m1/s1
C18H16N2O2S324.39683100
4194855

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)/p-1
C18H15N2O2S323.38891100
5294717

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)/p-1/t12-/m0/s1
C18H15N2O2S323.38891100
5294718

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H16N2O2S/c1-12(17(21)22)23-18-19-15(13-8-4-2-5-9-13)16(20-18)14-10-6-3-7-11-14/h2-12H,1H3,(H,19,20)(H,21,22)/p-1/t12-/m1/s1
C18H15N2O2S323.38891100

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