methyl 2-[methyl-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethanoate

Systemtic Name: methyl 2-[methyl-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethanoate Openeye Name: methyl 2-[methyl-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]acetate CAS Name: 2-[methyl-[5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-(5-nitro-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]acetate Traditional Name: 2-[methyl-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amino]acetic acid methyl ester Formula: C12H17N5O4 MolecularWeight: 295.29448

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CN(CC(=O)OC)C1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C12H17N5O4/c1-15(7-9(18)21-2)11-10(17(19)20)12(14-8-13-11)16-5-3-4-6-16/h8H,3-7H2,1-2H3