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(1,3-diethyl-9-oxidanylidene-thioxanthen-2-yl) 3-ethylheptaneperoxoate

(1,3-diethyl-9-oxidanylidene-thioxanthen-2-yl) 3-ethylheptaneperoxoate

Systemtic Name:(1,3-diethyl-9-oxidanylidene-thioxanthen-2-yl) 3-ethylheptaneperoxoate
Openeye Name:(1,3-diethyl-9-oxo-thioxanthen-2-yl) 3-ethylheptaneperoxoate
CAS Name:3-ethylheptaneperoxoic acid (1,3-diethyl-9-oxo-2-thioxanthenyl) ester
IUPAC Name:(1,3-diethyl-9-oxothioxanthen-2-yl) 3-ethylheptaneperoxoate
Traditional Name:3-ethylperoxyenanthic acid (1,3-diethyl-9-keto-thioxanthen-2-yl) ester
Formula: C26H32O4S
MolecularWeight: 440.59488
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=O)OOC1=C(C2=C(C=C1CC)SC3=CC=CC=C3C2=O)CC


Isomeric SMILES

CCCCC(CC)CC(=O)OOC1=C(C2=C(C=C1CC)SC3=CC=CC=C3C2=O)CC


InChI

InChI=1S/C26H32O4S/c1-5-9-12-17(6-2)15-23(27)29-30-26-18(7-3)16-22-24(19(26)8-4)25(28)20-13-10-11-14-21(20)31-22/h10-11,13-14,16-17H,5-9,12,15H2,1-4H3


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