ethyl 2-bromanyl-3-[4-[2-(2-ethyl-4-methyl-6-oxidanylidene-pyrimidin-1-yl)ethoxy]phenyl]propanoate

Systemtic Name: ethyl 2-bromanyl-3-[4-[2-(2-ethyl-4-methyl-6-oxidanylidene-pyrimidin-1-yl)ethoxy]phenyl]propanoate Openeye Name: ethyl 2-bromo-3-[4-[2-(2-ethyl-4-methyl-6-oxo-pyrimidin-1-yl)ethoxy]phenyl]propanoate CAS Name: 2-bromo-3-[4-[2-(2-ethyl-4-methyl-6-oxo-1-pyrimidinyl)ethoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-bromo-3-[4-[2-(2-ethyl-4-methyl-6-oxopyrimidin-1-yl)ethoxy]phenyl]propanoate Traditional Name: 2-bromo-3-[4-[2-(2-ethyl-6-keto-4-methyl-pyrimidin-1-yl)ethoxy]phenyl]propionic acid ethyl ester Formula: C20H25BrN2O4 MolecularWeight: 437.3275

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)CC(C(=O)OCC)Br)C

Isomeric SMILES

CCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)CC(C(=O)OCC)Br)C

InChI

InChI=1S/C20H25BrN2O4/c1-4-18-22-14(3)12-19(24)23(18)10-11-27-16-8-6-15(7-9-16)13-17(21)20(25)26-5-2/h6-9,12,17H,4-5,10-11,13H2,1-3H3