methyl 4-[[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propanoylamino]methyl]benzoate CAS Name: 4-[[[1-oxo-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propanoylamino]methyl]benzoic acid methyl ester Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=NC(=NO2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=NC(=NO2)C3=CC=NC=C3

InChI

InChI=1S/C19H18N4O4/c1-26-19(25)15-4-2-13(3-5-15)12-21-16(24)6-7-17-22-18(23-27-17)14-8-10-20-11-9-14/h2-5,8-11H,6-7,12H2,1H3,(H,21,24)