2-[4-[(4-bromanyl-2-propanoyl-phenoxy)methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-bromanyl-2-propanoyl-phenoxy)methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(4-bromo-2-propanoyl-phenoxy)methyl]phenyl]acetic acid CAS Name: 2-[4-[[4-bromo-2-(1-oxopropyl)phenoxy]methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(4-bromo-2-propanoylphenoxy)methyl]phenyl]acetic acid Traditional Name: 2-[4-[(4-bromo-2-propionyl-phenoxy)methyl]phenyl]acetic acid Formula: C18H17BrO4 MolecularWeight: 377.22918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO4/c1-2-16(20)15-10-14(19)7-8-17(15)23-11-13-5-3-12(4-6-13)9-18(21)22/h3-8,10H,2,9,11H2,1H3,(H,21,22)