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: KFBRGCKMQKZGPT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2402725

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3
C17H21NO255.3547463000
696377

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3/t17-/m1/s1
C17H21NO255.35473100
696379

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3/t17-/m0/s1
C17H21NO255.35472100
5318142

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3/p+1/t17-/m1/s1
C17H22NO256.362681100
5318143

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3/p+1/t17-/m0/s1
C17H22NO256.362681100

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