2-[5-bromanyl-2-(3-phenylpropoxy)phenyl]ethanoic acid

Systemtic Name: 2-[5-bromanyl-2-(3-phenylpropoxy)phenyl]ethanoic acid Openeye Name: 2-[5-bromo-2-(3-phenylpropoxy)phenyl]acetic acid CAS Name: 2-[5-bromo-2-(3-phenylpropoxy)phenyl]acetic acid IUPAC Name: 2-[5-bromo-2-(3-phenylpropoxy)phenyl]acetic acid Traditional Name: 2-[5-bromo-2-(3-phenylpropoxy)phenyl]acetic acid Formula: C17H17BrO3 MolecularWeight: 349.21908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)CC(=O)O

InChI

InChI=1S/C17H17BrO3/c18-15-8-9-16(14(11-15)12-17(19)20)21-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,19,20)