(4-chloranyl-2-methoxycarbonyl-phenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (4-chloranyl-2-methoxycarbonyl-phenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (4-chloro-2-methoxycarbonyl-phenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (4-chloro-2-methoxycarbonylphenyl) ester IUPAC Name: (4-chloro-2-methoxycarbonylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2-carbomethoxy-4-chloro-phenyl) ester Formula: C19H18BrClO5 MolecularWeight: 441.70022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)OC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)OC)Br

InChI

InChI=1S/C19H18BrClO5/c1-3-4-9-25-17-7-5-12(10-15(17)20)18(22)26-16-8-6-13(21)11-14(16)19(23)24-2/h5-8,10-11H,3-4,9H2,1-2H3