(3,5-dimethylphenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (3,5-dimethylphenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (3,5-dimethylphenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (3,5-dimethylphenyl) 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(=CC(=C2)C)C)Br

Isomeric SMILES

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

InChI

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