3-(5-bromanyl-2-pentoxy-phenyl)propanoate

Systemtic Name: 3-(5-bromanyl-2-pentoxy-phenyl)propanoate Openeye Name: 3-(5-bromo-2-pentoxy-phenyl)propanoate CAS Name: 3-(5-bromo-2-pentoxyphenyl)propanoate IUPAC Name: 3-(5-bromo-2-pentoxyphenyl)propanoate Traditional Name: 3-(2-amoxy-5-bromo-phenyl)propionate Formula: C14H18BrO3- MolecularWeight: 314.19492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Br)CCC(=O)[O-]

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Br)CCC(=O)[O-]

InChI

InChI=1S/C14H19BrO3/c1-2-3-4-9-18-13-7-6-12(15)10-11(13)5-8-14(16)17/h6-7,10H,2-5,8-9H2,1H3,(H,16,17)/p-1