3-(3-bromanyl-5-ethoxy-4-phenethyloxy-phenyl)propanoate

Systemtic Name: 3-(3-bromanyl-5-ethoxy-4-phenethyloxy-phenyl)propanoate Openeye Name: 3-(3-bromo-5-ethoxy-4-phenethyloxy-phenyl)propanoate CAS Name: 3-(3-bromo-5-ethoxy-4-phenethyloxyphenyl)propanoate IUPAC Name: 3-(3-bromo-5-ethoxy-4-phenethyloxyphenyl)propanoate Traditional Name: 3-(3-bromo-5-ethoxy-4-phenethyloxy-phenyl)propionate Formula: C19H20BrO4- MolecularWeight: 392.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CCC(=O)[O-])Br)OCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CCC(=O)[O-])Br)OCCC2=CC=CC=C2

InChI

InChI=1S/C19H21BrO4/c1-2-23-17-13-15(8-9-18(21)22)12-16(20)19(17)24-11-10-14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3,(H,21,22)/p-1