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

Systemtic Name: 3-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethoxy]benzoic acid Openeye Name: 3-[2-(4-bromo-2-isopropyl-phenoxy)ethoxy]benzoic acid CAS Name: 3-[2-(4-bromo-2-propan-2-ylphenoxy)ethoxy]benzoic acid IUPAC Name: 3-[2-(4-bromo-2-propan-2-ylphenoxy)ethoxy]benzoic acid Traditional Name: 3-[2-(4-bromo-2-isopropyl-phenoxy)ethoxy]benzoic acid Formula: C18H19BrO4 MolecularWeight: 379.24506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrO4/c1-12(2)16-11-14(19)6-7-17(16)23-9-8-22-15-5-3-4-13(10-15)18(20)21/h3-7,10-12H,8-9H2,1-2H3,(H,20,21)