(2-bromanyl-4-methyl-phenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (2-bromo-4-methyl-phenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C18H18Br2O3 MolecularWeight: 442.14172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Br2O3/c1-3-4-9-22-16-8-6-13(11-15(16)20)18(21)23-17-7-5-12(2)10-14(17)19/h5-8,10-11H,3-4,9H2,1-2H3