3-[5-bromanyl-2-(3-phenylpropoxy)phenyl]propanoate

Systemtic Name: 3-[5-bromanyl-2-(3-phenylpropoxy)phenyl]propanoate Openeye Name: 3-[5-bromo-2-(3-phenylpropoxy)phenyl]propanoate CAS Name: 3-[5-bromo-2-(3-phenylpropoxy)phenyl]propanoate IUPAC Name: 3-[5-bromo-2-(3-phenylpropoxy)phenyl]propanoate Traditional Name: 3-[5-bromo-2-(3-phenylpropoxy)phenyl]propionate Formula: C18H18BrO3- MolecularWeight: 362.23772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-]

InChI

InChI=1S/C18H19BrO3/c19-16-9-10-17(15(13-16)8-11-18(20)21)22-12-4-7-14-5-2-1-3-6-14/h1-3,5-6,9-10,13H,4,7-8,11-12H2,(H,20,21)/p-1