4-[(2-bromanyl-4-methanoyl-6-methoxy-phenoxy)methyl]benzoic acid

Systemtic Name: 4-[(2-bromanyl-4-methanoyl-6-methoxy-phenoxy)methyl]benzoic acid Openeye Name: 4-[(2-bromo-4-formyl-6-methoxy-phenoxy)methyl]benzoic acid CAS Name: 4-[(2-bromo-4-formyl-6-methoxyphenoxy)methyl]benzoic acid IUPAC Name: 4-[(2-bromo-4-formyl-6-methoxyphenoxy)methyl]benzoic acid Traditional Name: 4-[(2-bromo-4-formyl-6-methoxy-phenoxy)methyl]benzoic acid Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H13BrO5/c1-21-14-7-11(8-18)6-13(17)15(14)22-9-10-2-4-12(5-3-10)16(19)20/h2-8H,9H2,1H3,(H,19,20)