methyl 2-[2-(5-azanyl-2-chloranyl-4-fluoranyl-phenoxy)pyrimidin-4-yl]oxyethanoate

Systemtic Name: methyl 2-[2-(5-azanyl-2-chloranyl-4-fluoranyl-phenoxy)pyrimidin-4-yl]oxyethanoate Openeye Name: methyl 2-[2-(5-amino-2-chloro-4-fluoro-phenoxy)pyrimidin-4-yl]oxyacetate CAS Name: 2-[[2-(5-amino-2-chloro-4-fluorophenoxy)-4-pyrimidinyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-(5-amino-2-chloro-4-fluorophenoxy)pyrimidin-4-yl]oxyacetate Traditional Name: 2-[2-(5-amino-2-chloro-4-fluoro-phenoxy)pyrimidin-4-yl]oxyacetic acid methyl ester Formula: C13H11ClFN3O4 MolecularWeight: 327.695543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=NC(=NC=C1)OC2=C(C=C(C(=C2)N)F)Cl

Isomeric SMILES

COC(=O)COC1=NC(=NC=C1)OC2=C(C=C(C(=C2)N)F)Cl

InChI

InChI=1S/C13H11ClFN3O4/c1-20-12(19)6-21-11-2-3-17-13(18-11)22-10-5-9(16)8(15)4-7(10)14/h2-5H,6,16H2,1H3