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(6-hexyl-2-oxidanylidene-oxan-3-yl) 4-phenylmethoxybenzoate

(6-hexyl-2-oxidanylidene-oxan-3-yl) 4-phenylmethoxybenzoate

Systemtic Name:(6-hexyl-2-oxidanylidene-oxan-3-yl) 4-phenylmethoxybenzoate
Openeye Name:(6-hexyl-2-oxo-tetrahydropyran-3-yl) 4-benzyloxybenzoate
CAS Name:4-phenylmethoxybenzoic acid (6-hexyl-2-oxo-3-oxanyl) ester
IUPAC Name:(6-hexyl-2-oxooxan-3-yl) 4-phenylmethoxybenzoate
Traditional Name:4-benzoxybenzoic acid (6-hexyl-2-keto-tetrahydropyran-3-yl) ester
Formula: C25H30O5
MolecularWeight: 410.5027
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(C(=O)O1)OC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3


Isomeric SMILES

CCCCCCC1CCC(C(=O)O1)OC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3


InChI

InChI=1S/C25H30O5/c1-2-3-4-8-11-22-16-17-23(25(27)29-22)30-24(26)20-12-14-21(15-13-20)28-18-19-9-6-5-7-10-19/h5-7,9-10,12-15,22-23H,2-4,8,11,16-18H2,1H3


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