3-[5-bromanyl-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propanoate

Systemtic Name: 3-[5-bromanyl-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propanoate Openeye Name: 3-[5-bromo-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propanoate CAS Name: 3-[5-bromo-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propanoate IUPAC Name: 3-[5-bromo-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propanoate Traditional Name: 3-[5-bromo-2-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]propionate Formula: C19H20BrO4- MolecularWeight: 392.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-])C

InChI

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