3-[(2-bromanyl-4-ethyl-phenoxy)methyl]benzoate

Systemtic Name: 3-[(2-bromanyl-4-ethyl-phenoxy)methyl]benzoate Openeye Name: 3-[(2-bromo-4-ethyl-phenoxy)methyl]benzoate CAS Name: 3-[(2-bromo-4-ethylphenoxy)methyl]benzoate IUPAC Name: 3-[(2-bromo-4-ethylphenoxy)methyl]benzoate Traditional Name: 3-[(2-bromo-4-ethyl-phenoxy)methyl]benzoate Formula: C16H14BrO3- MolecularWeight: 334.18456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])Br

InChI

InChI=1S/C16H15BrO3/c1-2-11-6-7-15(14(17)9-11)20-10-12-4-3-5-13(8-12)16(18)19/h3-9H,2,10H2,1H3,(H,18,19)/p-1