[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)C1=CC(=C(C=C1)OC)Br)C2=NC=CC=N2

Isomeric SMILES

CN(CC(=O)OCC(=O)C1=CC(=C(C=C1)OC)Br)C2=NC=CC=N2

InChI

InChI=1S/C16H16BrN3O4/c1-20(16-18-6-3-7-19-16)9-15(22)24-10-13(21)11-4-5-14(23-2)12(17)8-11/h3-8H,9-10H2,1-2H3