(4-butoxycarbonylphenyl) 3-bromanyl-4-propan-2-yloxy-benzoate

Systemtic Name: (4-butoxycarbonylphenyl) 3-bromanyl-4-propan-2-yloxy-benzoate Openeye Name: (4-butoxycarbonylphenyl) 3-bromo-4-isopropoxy-benzoate CAS Name: 3-bromo-4-propan-2-yloxybenzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 3-bromo-4-propan-2-yloxybenzoate Traditional Name: 3-bromo-4-isopropoxy-benzoic acid (4-butoxycarbonylphenyl) ester Formula: C21H23BrO5 MolecularWeight: 435.30832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(C)C)Br

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(C)C)Br

InChI

InChI=1S/C21H23BrO5/c1-4-5-12-25-20(23)15-6-9-17(10-7-15)27-21(24)16-8-11-19(18(22)13-16)26-14(2)3/h6-11,13-14H,4-5,12H2,1-3H3