3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxy-phenyl]propanoate

Systemtic Name: 3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxy-phenyl]propanoate Openeye Name: 3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxy-phenyl]propanoate CAS Name: 3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl]propanoate IUPAC Name: 3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl]propanoate Traditional Name: 3-[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxy-phenyl]propionate Formula: C21H25O5- MolecularWeight: 357.4202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCC(=O)[O-])OCCOC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCC(=O)[O-])OCCOC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C21H26O5/c1-4-24-20-14-17(7-10-21(22)23)6-9-19(20)26-12-11-25-18-8-5-15(2)16(3)13-18/h5-6,8-9,13-14H,4,7,10-12H2,1-3H3,(H,22,23)/p-1