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4-[6-(2-chloranyl-4-phenylmethoxy-phenoxy)hexyl]heptane-3,5-dione

4-[6-(2-chloranyl-4-phenylmethoxy-phenoxy)hexyl]heptane-3,5-dione

Systemtic Name:4-[6-(2-chloranyl-4-phenylmethoxy-phenoxy)hexyl]heptane-3,5-dione
Openeye Name:4-[6-(4-benzyloxy-2-chloro-phenoxy)hexyl]heptane-3,5-dione
CAS Name:4-[6-(2-chloro-4-phenylmethoxyphenoxy)hexyl]heptane-3,5-dione
IUPAC Name:4-[6-(2-chloro-4-phenylmethoxyphenoxy)hexyl]heptane-3,5-dione
Traditional Name:4-[6-(4-benzoxy-2-chloro-phenoxy)hexyl]heptane-3,5-dione
Formula: C26H33ClO4
MolecularWeight: 444.99082
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)OCC2=CC=CC=C2)Cl)C(=O)CC


Isomeric SMILES

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)OCC2=CC=CC=C2)Cl)C(=O)CC


InChI

InChI=1S/C26H33ClO4/c1-3-24(28)22(25(29)4-2)14-10-5-6-11-17-30-26-16-15-21(18-23(26)27)31-19-20-12-8-7-9-13-20/h7-9,12-13,15-16,18,22H,3-6,10-11,14,17,19H2,1-2H3


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