(2-phenethyloxycarbonylphenyl) 3-bromanyl-4-hexoxy-benzoate

Systemtic Name: (2-phenethyloxycarbonylphenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: (2-phenethyloxycarbonylphenyl) 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid [2-[oxo(phenethyloxy)methyl]phenyl] ester IUPAC Name: (2-phenethyloxycarbonylphenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-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)C(=O)OC2=CC=CC=C2C(=O)OCCC3=CC=CC=C3)Br

Isomeric SMILES

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

InChI

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