2-[4-chloranyl-6-(dimethylamino)-2-[(4-nitrophenyl)methyl]pyrimidin-5-yl]ethanoate

Systemtic Name: 2-[4-chloranyl-6-(dimethylamino)-2-[(4-nitrophenyl)methyl]pyrimidin-5-yl]ethanoate Openeye Name: 2-[4-chloro-6-(dimethylamino)-2-[(4-nitrophenyl)methyl]pyrimidin-5-yl]acetate CAS Name: 2-[4-chloro-6-(dimethylamino)-2-[(4-nitrophenyl)methyl]-5-pyrimidinyl]acetate IUPAC Name: 2-[4-chloro-6-(dimethylamino)-2-[(4-nitrophenyl)methyl]pyrimidin-5-yl]acetate Traditional Name: 2-[4-chloro-6-(dimethylamino)-2-(4-nitrobenzyl)pyrimidin-5-yl]acetate Formula: C15H14ClN4O4- MolecularWeight: 349.74906

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=NC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])Cl)CC(=O)[O-]

Isomeric SMILES

CN(C)C1=C(C(=NC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])Cl)CC(=O)[O-]

InChI

InChI=1S/C15H15ClN4O4/c1-19(2)15-11(8-13(21)22)14(16)17-12(18-15)7-9-3-5-10(6-4-9)20(23)24/h3-6H,7-8H2,1-2H3,(H,21,22)/p-1