4-[7-(4-phenylmethoxyphenoxy)heptyl]heptane-3,5-dione

Systemtic Name: 4-[7-(4-phenylmethoxyphenoxy)heptyl]heptane-3,5-dione Openeye Name: 4-[7-(4-benzyloxyphenoxy)heptyl]heptane-3,5-dione CAS Name: 4-[7-(4-phenylmethoxyphenoxy)heptyl]heptane-3,5-dione IUPAC Name: 4-[7-(4-phenylmethoxyphenoxy)heptyl]heptane-3,5-dione Traditional Name: 4-[7-(4-benzoxyphenoxy)heptyl]heptane-3,5-dione Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCCOC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCCOC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)CC

InChI

InChI=1S/C27H36O4/c1-3-26(28)25(27(29)4-2)15-11-6-5-7-12-20-30-23-16-18-24(19-17-23)31-21-22-13-9-8-10-14-22/h8-10,13-14,16-19,25H,3-7,11-12,15,20-21H2,1-2H3