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: QENMGFOYQMOXLS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4903086

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)/b30-25+
C28H33N3O2443.5805201500
4786910

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)/b30-25-
C28H33N3O2443.58058500
3418923

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)
C28H33N3O2443.580527500
4560408

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)/b30-25-/t22-/m1/s1
C28H33N3O2443.58052100
4560409

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)/b30-25-/t22-/m0/s1
C28H33N3O2443.58052100
62492614

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H33N3O2/c1-18(2)22-8-7-19(3)25(17-22)30-31-27(33)21-11-15-24(16-12-21)29-26(32)20-9-13-23(14-10-20)28(4,5)6/h7,9-16,22H,1,8,17H2,2-6H3,(H,29,32)(H,31,33)/b30-25+/t22-/m0/s1
C28H33N3O2443.58052200

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