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 6 results

Search term: VAGWSKFLSVQOSQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3268219

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3
C20H21FN4O2368.4047211100
1607379

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3/t17-/m0/s1
C20H21FN4O2368.40472100
1607381

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3/t17-/m1/s1
C20H21FN4O2368.40472100
3268218

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3/p+1
C20H22FN4O2369.41211100
1607380

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3/p+1/t17-/m1/s1
C20H22FN4O2369.41211100
1607378

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O2/c1-12-10-16-18(20(26)25(12)9-8-24(2)3)17(14(11-22)19(23)27-16)13-6-4-5-7-15(13)21/h4-7,10,17H,8-9,23H2,1-3H3/p+1/t17-/m0/s1
C20H22FN4O2369.41211100

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