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1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione

1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione

Systemtic Name:1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione
Openeye Name:1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione
CAS Name:1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione
IUPAC Name:1,8-didodecoxy-3-(hydroxymethyl)anthracene-9,10-dione
Traditional Name:1,8-dilauryloxy-3-methylol-9,10-anthraquinone
Formula: C39H58O5
MolecularWeight: 606.87482
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3C2=O)CO)OCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3C2=O)CO)OCCCCCCCCCCCC


InChI

InChI=1S/C39H58O5/c1-3-5-7-9-11-13-15-17-19-21-26-43-34-25-23-24-32-36(34)39(42)37-33(38(32)41)28-31(30-40)29-35(37)44-27-22-20-18-16-14-12-10-8-6-4-2/h23-25,28-29,40H,3-22,26-27,30H2,1-2H3


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