3-[(5-bromanyl-2-ethoxy-4-methanoyl-phenoxy)methyl]benzoic acid

Systemtic Name: 3-[(5-bromanyl-2-ethoxy-4-methanoyl-phenoxy)methyl]benzoic acid Openeye Name: 3-[(5-bromo-2-ethoxy-4-formyl-phenoxy)methyl]benzoic acid CAS Name: 3-[(5-bromo-2-ethoxy-4-formylphenoxy)methyl]benzoic acid IUPAC Name: 3-[(5-bromo-2-ethoxy-4-formylphenoxy)methyl]benzoic acid Traditional Name: 3-[(5-bromo-2-ethoxy-4-formyl-phenoxy)methyl]benzoic acid Formula: C17H15BrO5 MolecularWeight: 379.202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=O)Br)OCC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C=O)Br)OCC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H15BrO5/c1-2-22-15-7-13(9-19)14(18)8-16(15)23-10-11-4-3-5-12(6-11)17(20)21/h3-9H,2,10H2,1H3,(H,20,21)