N2-(3-methoxypropyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methoxypropyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-(3-methoxypropyl)-5-nitro-6-(1-piperidyl)pyrimidine-2,4-diamine CAS Name: N2-(3-methoxypropyl)-5-nitro-6-(1-piperidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methoxypropyl)-5-nitro-6-piperidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-piperidino-pyrimidin-2-yl)-(3-methoxypropyl)amine Formula: C13H22N6O3 MolecularWeight: 310.35218

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

COCCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C13H22N6O3/c1-22-9-5-6-15-13-16-11(14)10(19(20)21)12(17-13)18-7-3-2-4-8-18/h2-9H2,1H3,(H3,14,15,16,17)