methyl 2-[3-(6-carbamimidoylpyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate

Systemtic Name: methyl 2-[3-(6-carbamimidoylpyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate Openeye Name: methyl 2-[3-(6-carbamimidoyl-3-pyridyl)-4,5-dihydroisoxazol-5-yl]acetate CAS Name: 2-[3-(6-carbamimidoyl-3-pyridinyl)-4,5-dihydroisoxazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(6-carbamimidoylpyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]acetate Traditional Name: 2-[3-(6-amidino-3-pyridyl)-2-isoxazolin-5-yl]acetic acid methyl ester Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(=NO1)C2=CN=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CC1CC(=NO1)C2=CN=C(C=C2)C(=N)N

InChI

InChI=1S/C12H14N4O3/c1-18-11(17)5-8-4-10(16-19-8)7-2-3-9(12(13)14)15-6-7/h2-3,6,8H,4-5H2,1H3,(H3,13,14)