2-[(4-bromanyl-2-ethyl-phenoxy)methyl]benzoic acid

Systemtic Name: 2-[(4-bromanyl-2-ethyl-phenoxy)methyl]benzoic acid Openeye Name: 2-[(4-bromo-2-ethyl-phenoxy)methyl]benzoic acid CAS Name: 2-[(4-bromo-2-ethylphenoxy)methyl]benzoic acid IUPAC Name: 2-[(4-bromo-2-ethylphenoxy)methyl]benzoic acid Traditional Name: 2-[(4-bromo-2-ethyl-phenoxy)methyl]benzoic acid Formula: C16H15BrO3 MolecularWeight: 335.1925

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2C(=O)O

InChI

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