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: HAQADVLPULXNNC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4082630

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H32N2O5/c1-4-6-18-15-21(26)30-20-14-16(2)13-19(22(18)20)29-17(3)23(27)24-7-5-8-25-9-11-28-12-10-25/h13-15,17H,4-12H2,1-3H3,(H,24,27)
C23H32N2O5416.51058151100
6332356

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H32N2O5/c1-4-6-18-15-21(26)30-20-14-16(2)13-19(22(18)20)29-17(3)23(27)24-7-5-8-25-9-11-28-12-10-25/h13-15,17H,4-12H2,1-3H3,(H,24,27)/t17-/m0/s1
C23H32N2O5416.51062100
6332358

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H32N2O5/c1-4-6-18-15-21(26)30-20-14-16(2)13-19(22(18)20)29-17(3)23(27)24-7-5-8-25-9-11-28-12-10-25/h13-15,17H,4-12H2,1-3H3,(H,24,27)/t17-/m1/s1
C23H32N2O5416.51062100
6332357

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H32N2O5/c1-4-6-18-15-21(26)30-20-14-16(2)13-19(22(18)20)29-17(3)23(27)24-7-5-8-25-9-11-28-12-10-25/h13-15,17H,4-12H2,1-3H3,(H,24,27)/p+1/t17-/m1/s1
C23H33N2O5417.5181100
6332355

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H32N2O5/c1-4-6-18-15-21(26)30-20-14-16(2)13-19(22(18)20)29-17(3)23(27)24-7-5-8-25-9-11-28-12-10-25/h13-15,17H,4-12H2,1-3H3,(H,24,27)/p+1/t17-/m0/s1
C23H33N2O5417.5181100

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