[4-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(oxolan-2-ylmethoxy)benzoate

Systemtic Name: [4-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(oxolan-2-ylmethoxy)benzoate Openeye Name: [4-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-(tetrahydrofuran-2-ylmethoxy)benzoate CAS Name: 3-bromo-4-(2-oxolanylmethoxy)benzoic acid [4-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [4-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-(oxolan-2-ylmethoxy)benzoate Traditional Name: 3-bromo-4-(tetrahydrofurfuryloxy)benzoic acid [4-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C28H27BrO6 MolecularWeight: 539.41438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCCCC4=CC=CC=C4)Br

Isomeric SMILES

C1CC(OC1)COC2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCCCC4=CC=CC=C4)Br

InChI

InChI=1S/C28H27BrO6/c29-25-18-22(12-15-26(25)34-19-24-9-5-16-32-24)28(31)35-23-13-10-21(11-14-23)27(30)33-17-4-8-20-6-2-1-3-7-20/h1-3,6-7,10-15,18,24H,4-5,8-9,16-17,19H2