3-[2-(4-bromanyl-2-ethyl-phenoxy)ethoxy]benzoic acid

Systemtic Name: 3-[2-(4-bromanyl-2-ethyl-phenoxy)ethoxy]benzoic acid Openeye Name: 3-[2-(4-bromo-2-ethyl-phenoxy)ethoxy]benzoic acid CAS Name: 3-[2-(4-bromo-2-ethylphenoxy)ethoxy]benzoic acid IUPAC Name: 3-[2-(4-bromo-2-ethylphenoxy)ethoxy]benzoic acid Traditional Name: 3-[2-(4-bromo-2-ethyl-phenoxy)ethoxy]benzoic acid Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H17BrO4/c1-2-12-10-14(18)6-7-16(12)22-9-8-21-15-5-3-4-13(11-15)17(19)20/h3-7,10-11H,2,8-9H2,1H3,(H,19,20)