ethyl 2-[2-bromanyl-4-[3-bromanyl-4-(1-ethoxy-1-oxidanylidene-octan-2-yl)oxy-phenoxy]phenoxy]octanoate

Systemtic Name: ethyl 2-[2-bromanyl-4-[3-bromanyl-4-(1-ethoxy-1-oxidanylidene-octan-2-yl)oxy-phenoxy]phenoxy]octanoate Openeye Name: ethyl 2-[2-bromo-4-[3-bromo-4-(1-ethoxycarbonylheptoxy)phenoxy]phenoxy]octanoate CAS Name: 2-[2-bromo-4-[3-bromo-4-(1-ethoxy-1-oxooctan-2-yl)oxyphenoxy]phenoxy]octanoic acid ethyl ester IUPAC Name: ethyl 2-[2-bromo-4-[3-bromo-4-(1-ethoxy-1-oxooctan-2-yl)oxyphenoxy]phenoxy]octanoate Traditional Name: 2-[2-bromo-4-[3-bromo-4-(1-carbethoxyheptoxy)phenoxy]phenoxy]caprylic acid ethyl ester Formula: C32H44Br2O7 MolecularWeight: 700.49556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OCC)OC1=C(C=C(C=C1)OC2=CC(=C(C=C2)OC(CCCCCC)C(=O)OCC)Br)Br

Isomeric SMILES

CCCCCCC(C(=O)OCC)OC1=C(C=C(C=C1)OC2=CC(=C(C=C2)OC(CCCCCC)C(=O)OCC)Br)Br

InChI

InChI=1S/C32H44Br2O7/c1-5-9-11-13-15-29(31(35)37-7-3)40-27-19-17-23(21-25(27)33)39-24-18-20-28(26(34)22-24)41-30(32(36)38-8-4)16-14-12-10-6-2/h17-22,29-30H,5-16H2,1-4H3