methyl 3-[4-(2-acetyloxy-2-pyridin-2-yl-ethoxy)phenyl]-2-bromanyl-propanoate

Systemtic Name: methyl 3-[4-(2-acetyloxy-2-pyridin-2-yl-ethoxy)phenyl]-2-bromanyl-propanoate Openeye Name: methyl 3-[4-[2-acetoxy-2-(2-pyridyl)ethoxy]phenyl]-2-bromo-propanoate CAS Name: 3-[4-[2-acetyloxy-2-(2-pyridinyl)ethoxy]phenyl]-2-bromopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-acetyloxy-2-pyridin-2-ylethoxy)phenyl]-2-bromopropanoate Traditional Name: 3-[4-[2-acetoxy-2-(2-pyridyl)ethoxy]phenyl]-2-bromo-propionic acid methyl ester Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(COC1=CC=C(C=C1)CC(C(=O)OC)Br)C2=CC=CC=N2

Isomeric SMILES

CC(=O)OC(COC1=CC=C(C=C1)CC(C(=O)OC)Br)C2=CC=CC=N2

InChI

InChI=1S/C19H20BrNO5/c1-13(22)26-18(17-5-3-4-10-21-17)12-25-15-8-6-14(7-9-15)11-16(20)19(23)24-2/h3-10,16,18H,11-12H2,1-2H3