(2R)-1-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]proline Formula: C14H20N6O4 MolecularWeight: 336.3464

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)N3CCCC3C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)N3CCC[C@@H]3C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H20N6O4/c1-17-5-7-18(8-6-17)12-11(20(23)24)13(16-9-15-12)19-4-2-3-10(19)14(21)22/h9-10H,2-8H2,1H3,(H,21,22)/t10-/m1/s1