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1-tridecyldibenzo-p-dioxin-2,3-diol

1-tridecyldibenzo-p-dioxin-2,3-diol

Systemtic Name:1-tridecyldibenzo-p-dioxin-2,3-diol
Openeye Name:1-tridecyldibenzo-p-dioxin-2,3-diol
CAS Name:1-tridecyldibenzo-p-dioxin-2,3-diol
IUPAC Name:1-tridecyldibenzo-p-dioxin-2,3-diol
Traditional Name:1-tridecyldibenzo-p-dioxin-2,3-diol
Formula: C25H34O4
MolecularWeight: 398.53506
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=C2C(=CC(=C1O)O)OC3=CC=CC=C3O2


Isomeric SMILES

CCCCCCCCCCCCCC1=C2C(=CC(=C1O)O)OC3=CC=CC=C3O2


InChI

InChI=1S/C25H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-19-24(27)20(26)18-23-25(19)29-22-17-14-13-16-21(22)28-23/h13-14,16-18,26-27H,2-12,15H2,1H3


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