methyl 2-[methyl-[6-[methyl(phenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[6-[methyl(phenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanoate Openeye Name: methyl 2-[methyl-[6-(N-methylanilino)-5-nitro-pyrimidin-4-yl]amino]acetate CAS Name: 2-[methyl-[6-(N-methylanilino)-5-nitro-4-pyrimidinyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[6-(N-methylanilino)-5-nitropyrimidin-4-yl]amino]acetate Traditional Name: 2-[methyl-[6-(N-methylanilino)-5-nitro-pyrimidin-4-yl]amino]acetic acid methyl ester Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=NC=NC(=C1[N+](=O)[O-])N(C)C2=CC=CC=C2

Isomeric SMILES

CN(CC(=O)OC)C1=NC=NC(=C1[N+](=O)[O-])N(C)C2=CC=CC=C2

InChI

InChI=1S/C15H17N5O4/c1-18(9-12(21)24-3)14-13(20(22)23)15(17-10-16-14)19(2)11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3