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 4 results

Search term: HEUNEABXWFMPCN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
12281461

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C32H32N4O3/c1-5-6-10-13-35-31(37)27(22(4)28(18-33)32(35)38)17-25-19-36(26-11-8-7-9-12-26)34-29(25)23-14-20(2)30-24(16-23)15-21(3)39-30/h7-9,11-12,14,16-17,19,21H,5-6,10,13,15H2,1-4H3/b27-17-
C32H32N4O3520.6215141000
11998047

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C32H32N4O3/c1-5-6-10-13-35-31(37)27(22(4)28(18-33)32(35)38)17-25-19-36(26-11-8-7-9-12-26)34-29(25)23-14-20(2)30-24(16-23)15-21(3)39-30/h7-9,11-12,14,16-17,19,21H,5-6,10,13,15H2,1-4H3/b27-17+
C32H32N4O3520.62153200
62585403

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C32H32N4O3/c1-5-6-10-13-35-31(37)27(22(4)28(18-33)32(35)38)17-25-19-36(26-11-8-7-9-12-26)34-29(25)23-14-20(2)30-24(16-23)15-21(3)39-30/h7-9,11-12,14,16-17,19,21H,5-6,10,13,15H2,1-4H3/b27-17-/t21-/m0/s1
C32H32N4O3520.62152200
35379975

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C32H32N4O3/c1-5-6-10-13-35-31(37)27(22(4)28(18-33)32(35)38)17-25-19-36(26-11-8-7-9-12-26)34-29(25)23-14-20(2)30-24(16-23)15-21(3)39-30/h7-9,11-12,14,16-17,19,21H,5-6,10,13,15H2,1-4H3
C32H32N4O3520.62151100

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