(3-propoxycarbonylphenyl) 5-bromanyl-2-hexoxy-benzoate

Systemtic Name: (3-propoxycarbonylphenyl) 5-bromanyl-2-hexoxy-benzoate Openeye Name: (3-propoxycarbonylphenyl) 5-bromo-2-hexoxy-benzoate CAS Name: 5-bromo-2-hexoxybenzoic acid [3-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (3-propoxycarbonylphenyl) 5-bromo-2-hexoxybenzoate Traditional Name: 5-bromo-2-hexoxy-benzoic acid (3-propoxycarbonylphenyl) ester Formula: C23H27BrO5 MolecularWeight: 463.36148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC(=C2)C(=O)OCCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC(=C2)C(=O)OCCC

InChI

InChI=1S/C23H27BrO5/c1-3-5-6-7-14-27-21-12-11-18(24)16-20(21)23(26)29-19-10-8-9-17(15-19)22(25)28-13-4-2/h8-12,15-16H,3-7,13-14H2,1-2H3