(3-propoxycarbonylphenyl) 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: (3-propoxycarbonylphenyl) 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: (3-propoxycarbonylphenyl) 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid [3-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (3-propoxycarbonylphenyl) 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid (3-propoxycarbonylphenyl) ester Formula: C25H23BrO5 MolecularWeight: 483.35112

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C25H23BrO5/c1-2-14-30-24(27)19-9-6-10-21(16-19)31-25(28)20-11-12-23(22(26)17-20)29-15-13-18-7-4-3-5-8-18/h3-12,16-17H,2,13-15H2,1H3