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: LBDHKBFIUGVKSQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
480081

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C20H31N3O/c1-18(2,3)21-13-20(24)17-11-22-9-10-23(12-17)15-19(20,14-22)16-7-5-4-6-8-16/h4-8,17,21,24H,9-15H2,1-3H3
C20H31N3O329.4796181400
763124

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C20H31N3O/c1-18(2,3)21-13-20(24)17-11-22-9-10-23(12-17)15-19(20,14-22)16-7-5-4-6-8-16/h4-8,17,21,24H,9-15H2,1-3H3/t17?,19?,20-/m1/s1
C20H31N3O329.47962100
5024462

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C20H31N3O/c1-18(2,3)21-13-20(24)17-11-22-9-10-23(12-17)15-19(20,14-22)16-7-5-4-6-8-16/h4-8,17,21,24H,9-15H2,1-3H3/t17?,19?,20-/m0/s1
C20H31N3O329.47962100
5446419

Charge

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C20H31N3O/c1-18(2,3)21-13-20(24)17-11-22-9-10-23(12-17)15-19(20,14-22)16-7-5-4-6-8-16/h4-8,17,21,24H,9-15H2,1-3H3/p+3/t17?,19?,20-/m0/s1
C20H34N3O332.50181100
1709148

Charge

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C20H31N3O/c1-18(2,3)21-13-20(24)17-11-22-9-10-23(12-17)15-19(20,14-22)16-7-5-4-6-8-16/h4-8,17,21,24H,9-15H2,1-3H3/p+3/t17?,19?,20-/m1/s1
C20H34N3O332.50181100

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