3-[3-chloranyl-5-ethoxy-4-(3-phenylpropoxy)phenyl]propanoate

Systemtic Name: 3-[3-chloranyl-5-ethoxy-4-(3-phenylpropoxy)phenyl]propanoate Openeye Name: 3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]propanoate CAS Name: 3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]propanoate IUPAC Name: 3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]propanoate Traditional Name: 3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]propionate Formula: C20H22ClO4- MolecularWeight: 361.83928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CCC(=O)[O-])Cl)OCCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CCC(=O)[O-])Cl)OCCCC2=CC=CC=C2

InChI

InChI=1S/C20H23ClO4/c1-2-24-18-14-16(10-11-19(22)23)13-17(21)20(18)25-12-6-9-15-7-4-3-5-8-15/h3-5,7-8,13-14H,2,6,9-12H2,1H3,(H,22,23)/p-1