[4-(2-methoxyethoxycarbonyl)phenyl] 3-bromanyl-4-butoxy-benzoate

Systemtic Name: [4-(2-methoxyethoxycarbonyl)phenyl] 3-bromanyl-4-butoxy-benzoate Openeye Name: [4-(2-methoxyethoxycarbonyl)phenyl] 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid [4-[2-methoxyethoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methoxyethoxycarbonyl)phenyl] 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid [4-(2-methoxyethoxycarbonyl)phenyl] ester Formula: C21H23BrO6 MolecularWeight: 451.30772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCOC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCOC)Br

InChI

InChI=1S/C21H23BrO6/c1-3-4-11-26-19-10-7-16(14-18(19)22)21(24)28-17-8-5-15(6-9-17)20(23)27-13-12-25-2/h5-10,14H,3-4,11-13H2,1-2H3