[3-(2-methylpropoxycarbonyl)phenyl] 3-bromanyl-4-ethoxy-benzoate

Systemtic Name: [3-(2-methylpropoxycarbonyl)phenyl] 3-bromanyl-4-ethoxy-benzoate Openeye Name: (3-isobutoxycarbonylphenyl) 3-bromo-4-ethoxy-benzoate CAS Name: 3-bromo-4-ethoxybenzoic acid [3-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [3-(2-methylpropoxycarbonyl)phenyl] 3-bromo-4-ethoxybenzoate Traditional Name: 3-bromo-4-ethoxy-benzoic acid (3-isobutoxycarbonylphenyl) ester Formula: C20H21BrO5 MolecularWeight: 421.28174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCC(C)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCC(C)C)Br

InChI

InChI=1S/C20H21BrO5/c1-4-24-18-9-8-15(11-17(18)21)20(23)26-16-7-5-6-14(10-16)19(22)25-12-13(2)3/h5-11,13H,4,12H2,1-3H3