[4-(oxolan-2-ylmethoxycarbonyl)phenyl] 3-bromanyl-4-(2-methylpropoxy)benzoate

Systemtic Name: [4-(oxolan-2-ylmethoxycarbonyl)phenyl] 3-bromanyl-4-(2-methylpropoxy)benzoate Openeye Name: [4-(tetrahydrofuran-2-ylmethoxycarbonyl)phenyl] 3-bromo-4-isobutoxy-benzoate CAS Name: 3-bromo-4-(2-methylpropoxy)benzoic acid [4-[oxo(2-oxolanylmethoxy)methyl]phenyl] ester IUPAC Name: [4-(oxolan-2-ylmethoxycarbonyl)phenyl] 3-bromo-4-(2-methylpropoxy)benzoate Traditional Name: 3-bromo-4-isobutoxy-benzoic acid [4-(tetrahydrofurfuryloxycarbonyl)phenyl] ester Formula: C23H25BrO6 MolecularWeight: 477.345

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC3CCCO3)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC3CCCO3)Br

InChI

InChI=1S/C23H25BrO6/c1-15(2)13-28-21-10-7-17(12-20(21)24)23(26)30-18-8-5-16(6-9-18)22(25)29-14-19-4-3-11-27-19/h5-10,12,15,19H,3-4,11,13-14H2,1-2H3