3-phenylpropyl 4-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoyloxy]benzoate

Systemtic Name: 3-phenylpropyl 4-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoyloxy]benzoate Openeye Name: 3-phenylpropyl 4-[2-(2-bromo-4-phenyl-phenoxy)acetyl]oxybenzoate CAS Name: 4-[2-(2-bromo-4-phenylphenoxy)-1-oxoethoxy]benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[2-(2-bromo-4-phenylphenoxy)acetyl]oxybenzoate Traditional Name: 4-[2-(2-bromo-4-phenyl-phenoxy)acetyl]oxybenzoic acid 3-phenylpropyl ester Formula: C30H25BrO5 MolecularWeight: 545.4205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)C2=CC=C(C=C2)OC(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)C2=CC=C(C=C2)OC(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C30H25BrO5/c31-27-20-25(23-11-5-2-6-12-23)15-18-28(27)35-21-29(32)36-26-16-13-24(14-17-26)30(33)34-19-7-10-22-8-3-1-4-9-22/h1-6,8-9,11-18,20H,7,10,19,21H2