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: VHGMCCVCICKOAP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
6779896

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H28N4O5S/c1-5-27-18(24)22-11-9-21(10-12-22)14(2)17(23)19-15-7-6-8-16(13-15)28(25,26)20(3)4/h6-8,13-14H,5,9-12H2,1-4H3,(H,19,23)/t14-/m0/s1
C18H28N4O5S412.50372100
6779899

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H28N4O5S/c1-5-27-18(24)22-11-9-21(10-12-22)14(2)17(23)19-15-7-6-8-16(13-15)28(25,26)20(3)4/h6-8,13-14H,5,9-12H2,1-4H3,(H,19,23)/t14-/m1/s1
C18H28N4O5S412.50372100
70010740

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H28N4O5S/c1-5-27-18(24)22-11-9-21(10-12-22)14(2)17(23)19-15-7-6-8-16(13-15)28(25,26)20(3)4/h6-8,13-14H,5,9-12H2,1-4H3,(H,19,23)
C18H28N4O5S412.50371100
6779898

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H28N4O5S/c1-5-27-18(24)22-11-9-21(10-12-22)14(2)17(23)19-15-7-6-8-16(13-15)28(25,26)20(3)4/h6-8,13-14H,5,9-12H2,1-4H3,(H,19,23)/p+1/t14-/m1/s1
C18H29N4O5S413.51111100
6779895

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H28N4O5S/c1-5-27-18(24)22-11-9-21(10-12-22)14(2)17(23)19-15-7-6-8-16(13-15)28(25,26)20(3)4/h6-8,13-14H,5,9-12H2,1-4H3,(H,19,23)/p+1/t14-/m0/s1
C18H29N4O5S413.51111100

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