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

Systemtic Name: 3-[3-bromanyl-5-chloranyl-2-(3-phenylpropoxy)phenyl]propanoate Openeye Name: 3-[3-bromo-5-chloro-2-(3-phenylpropoxy)phenyl]propanoate CAS Name: 3-[3-bromo-5-chloro-2-(3-phenylpropoxy)phenyl]propanoate IUPAC Name: 3-[3-bromo-5-chloro-2-(3-phenylpropoxy)phenyl]propanoate Traditional Name: 3-[3-bromo-5-chloro-2-(3-phenylpropoxy)phenyl]propionate Formula: C18H17BrClO3- MolecularWeight: 396.68278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2CCC(=O)[O-])Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2CCC(=O)[O-])Cl)Br

InChI

InChI=1S/C18H18BrClO3/c19-16-12-15(20)11-14(8-9-17(21)22)18(16)23-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,11-12H,4,7-10H2,(H,21,22)/p-1