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

Systemtic Name: 3-(3-bromanyl-4-hexoxy-phenyl)propanoate Openeye Name: 3-(3-bromo-4-hexoxy-phenyl)propanoate CAS Name: 3-(3-bromo-4-hexoxyphenyl)propanoate IUPAC Name: 3-(3-bromo-4-hexoxyphenyl)propanoate Traditional Name: 3-(3-bromo-4-hexoxy-phenyl)propionate Formula: C15H20BrO3- MolecularWeight: 328.2215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CCC(=O)[O-])Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CCC(=O)[O-])Br

InChI

InChI=1S/C15H21BrO3/c1-2-3-4-5-10-19-14-8-6-12(11-13(14)16)7-9-15(17)18/h6,8,11H,2-5,7,9-10H2,1H3,(H,17,18)/p-1