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: ROPPZINQYHJNAA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4660790

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3/b22-19+
C29H32N4O2468.59191300
2144985

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3
C29H32N4O2468.589987600
20183769

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3/b22-19-
C29H32N4O2468.594200
1021533

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3/b22-19+/t25-,28+/m1/s1
C29H32N4O2468.592100
5345012

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3/b22-19+/t25-,28-/m1/s1
C29H32N4O2468.592100
10121262

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H32N4O2/c1-31(2)23-14-10-20(11-15-23)19-22-7-5-8-25-27(22)30-33(29(34)26-9-6-18-35-26)28(25)21-12-16-24(17-13-21)32(3)4/h6,9-19,25,28H,5,7-8H2,1-4H3/b22-19+/t25-,28+/m0/s1
C29H32N4O2468.592100

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