3-[3-bromanyl-4-[2-(2-methylphenoxy)ethoxy]phenyl]propanoate

Systemtic Name: 3-[3-bromanyl-4-[2-(2-methylphenoxy)ethoxy]phenyl]propanoate Openeye Name: 3-[3-bromo-4-[2-(2-methylphenoxy)ethoxy]phenyl]propanoate CAS Name: 3-[3-bromo-4-[2-(2-methylphenoxy)ethoxy]phenyl]propanoate IUPAC Name: 3-[3-bromo-4-[2-(2-methylphenoxy)ethoxy]phenyl]propanoate Traditional Name: 3-[3-bromo-4-[2-(2-methylphenoxy)ethoxy]phenyl]propionate Formula: C18H18BrO4- MolecularWeight: 378.23712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOC2=C(C=C(C=C2)CCC(=O)[O-])Br

Isomeric SMILES

CC1=CC=CC=C1OCCOC2=C(C=C(C=C2)CCC(=O)[O-])Br

InChI

InChI=1S/C18H19BrO4/c1-13-4-2-3-5-16(13)22-10-11-23-17-8-6-14(12-15(17)19)7-9-18(20)21/h2-6,8,12H,7,9-11H2,1H3,(H,20,21)/p-1