[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 4-(diethylamino)benzoate

Systemtic Name: [2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 4-(diethylamino)benzoate Openeye Name: [2-oxo-2-(pyrimidin-2-ylamino)ethyl] 4-(diethylamino)benzoate CAS Name: 4-(diethylamino)benzoic acid [2-oxo-2-(2-pyrimidinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pyrimidin-2-ylamino)ethyl] 4-(diethylamino)benzoate Traditional Name: 4-(diethylamino)benzoic acid [2-keto-2-(2-pyrimidylamino)ethyl] ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=NC=CC=N2

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=NC=CC=N2

InChI

InChI=1S/C17H20N4O3/c1-3-21(4-2)14-8-6-13(7-9-14)16(23)24-12-15(22)20-17-18-10-5-11-19-17/h5-11H,3-4,12H2,1-2H3,(H,18,19,20,22)