(2-phenethyloxycarbonylphenyl) 5-bromanyl-2-hexoxy-benzoate

Systemtic Name: (2-phenethyloxycarbonylphenyl) 5-bromanyl-2-hexoxy-benzoate Openeye Name: (2-phenethyloxycarbonylphenyl) 5-bromo-2-hexoxy-benzoate CAS Name: 5-bromo-2-hexoxybenzoic acid [2-[oxo(phenethyloxy)methyl]phenyl] ester IUPAC Name: (2-phenethyloxycarbonylphenyl) 5-bromo-2-hexoxybenzoate Traditional Name: 5-bromo-2-hexoxy-benzoic acid (2-phenethyloxycarbonylphenyl) ester Formula: C28H29BrO5 MolecularWeight: 525.43086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC=C2C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC=C2C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C28H29BrO5/c1-2-3-4-10-18-32-25-16-15-22(29)20-24(25)28(31)34-26-14-9-8-13-23(26)27(30)33-19-17-21-11-6-5-7-12-21/h5-9,11-16,20H,2-4,10,17-19H2,1H3