3-(3-bromanyl-4-phenethyloxy-phenyl)propanoate

Systemtic Name: 3-(3-bromanyl-4-phenethyloxy-phenyl)propanoate Openeye Name: 3-(3-bromo-4-phenethyloxy-phenyl)propanoate CAS Name: 3-(3-bromo-4-phenethyloxyphenyl)propanoate IUPAC Name: 3-(3-bromo-4-phenethyloxyphenyl)propanoate Traditional Name: 3-(3-bromo-4-phenethyloxy-phenyl)propionate Formula: C17H16BrO3- MolecularWeight: 348.21114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)CCC(=O)[O-])Br

InChI

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