(4-hexoxyphenyl) 4-[8-(oxiran-2-yl)octoxy]benzoate

Systemtic Name: (4-hexoxyphenyl) 4-[8-(oxiran-2-yl)octoxy]benzoate Openeye Name: (4-hexoxyphenyl) 4-[8-(oxiran-2-yl)octoxy]benzoate CAS Name: 4-[8-(2-oxiranyl)octoxy]benzoic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 4-[8-(oxiran-2-yl)octoxy]benzoate Traditional Name: 4-[8-(oxiran-2-yl)octoxy]benzoic acid (4-hexoxyphenyl) ester Formula: C29H40O5 MolecularWeight: 468.6249

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCC3CO3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCC3CO3

InChI

InChI=1S/C29H40O5/c1-2-3-4-10-21-32-26-17-19-27(20-18-26)34-29(30)24-13-15-25(16-14-24)31-22-11-8-6-5-7-9-12-28-23-33-28/h13-20,28H,2-12,21-23H2,1H3