N4,N6-bis(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-bis(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-bis(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-bis(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-bis(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 3-methoxypropyl-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C12H21N5O4 MolecularWeight: 299.32624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N5O4/c1-20-7-3-5-13-11-10(17(18)19)12(16-9-15-11)14-6-4-8-21-2/h9H,3-8H2,1-2H3,(H2,13,14,15,16)