(4-ethylphenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (4-ethylphenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (4-ethylphenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (4-ethylphenyl) ester Formula: C19H21BrO3 MolecularWeight: 377.27224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrO3/c1-3-5-12-22-18-11-8-15(13-17(18)20)19(21)23-16-9-6-14(4-2)7-10-16/h6-11,13H,3-5,12H2,1-2H3