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: HHULYIVPCGNGPI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10927993

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H30N2O5S/c1-14(2)12-18(20(24)25)21-19(23)15-8-7-11-17(13-15)28(26,27)22(3)16-9-5-4-6-10-16/h7-8,11,13-14,16,18H,4-6,9-10,12H2,1-3H3,(H,21,23)(H,24,25)
C20H30N2O5S410.52765200
7687802

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H30N2O5S/c1-14(2)12-18(20(24)25)21-19(23)15-8-7-11-17(13-15)28(26,27)22(3)16-9-5-4-6-10-16/h7-8,11,13-14,16,18H,4-6,9-10,12H2,1-3H3,(H,21,23)(H,24,25)/t18-/m0/s1
C20H30N2O5S410.52762100
7687810

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H30N2O5S/c1-14(2)12-18(20(24)25)21-19(23)15-8-7-11-17(13-15)28(26,27)22(3)16-9-5-4-6-10-16/h7-8,11,13-14,16,18H,4-6,9-10,12H2,1-3H3,(H,21,23)(H,24,25)/t18-/m1/s1
C20H30N2O5S410.52762100
7687801

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H30N2O5S/c1-14(2)12-18(20(24)25)21-19(23)15-8-7-11-17(13-15)28(26,27)22(3)16-9-5-4-6-10-16/h7-8,11,13-14,16,18H,4-6,9-10,12H2,1-3H3,(H,21,23)(H,24,25)/p-1/t18-/m0/s1
C20H29N2O5S409.52021100
7687809

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H30N2O5S/c1-14(2)12-18(20(24)25)21-19(23)15-8-7-11-17(13-15)28(26,27)22(3)16-9-5-4-6-10-16/h7-8,11,13-14,16,18H,4-6,9-10,12H2,1-3H3,(H,21,23)(H,24,25)/p-1/t18-/m1/s1
C20H29N2O5S409.52021100

Advertisement