methyl 2-[2-(aminomethyl)pyrimidin-5-yl]-6-fluoranyl-benzoate

Systemtic Name: methyl 2-[2-(aminomethyl)pyrimidin-5-yl]-6-fluoranyl-benzoate Openeye Name: methyl 2-[2-(aminomethyl)pyrimidin-5-yl]-6-fluoro-benzoate CAS Name: 2-[2-(aminomethyl)-5-pyrimidinyl]-6-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-[2-(aminomethyl)pyrimidin-5-yl]-6-fluorobenzoate Traditional Name: 2-[2-(aminomethyl)pyrimidin-5-yl]-6-fluoro-benzoic acid methyl ester Formula: C13H12FN3O2 MolecularWeight: 261.251683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1F)C2=CN=C(N=C2)CN

Isomeric SMILES

COC(=O)C1=C(C=CC=C1F)C2=CN=C(N=C2)CN

InChI

InChI=1S/C13H12FN3O2/c1-19-13(18)12-9(3-2-4-10(12)14)8-6-16-11(5-15)17-7-8/h2-4,6-7H,5,15H2,1H3