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N4,N6-dihexadecyl-5-nitro-pyrimidine-4,6-diamine

N4,N6-dihexadecyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name:N4,N6-dihexadecyl-5-nitro-pyrimidine-4,6-diamine
Openeye Name:N4,N6-dihexadecyl-5-nitro-pyrimidine-4,6-diamine
CAS Name:N4,N6-dihexadecyl-5-nitropyrimidine-4,6-diamine
IUPAC Name:4-N,6-N-dihexadecyl-5-nitropyrimidine-4,6-diamine
Traditional Name:cetyl-[6-(cetylamino)-5-nitro-pyrimidin-4-yl]amine
Formula: C36H69N5O2
MolecularWeight: 603.96536
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NCCCCCCCCCCCCCCCC)[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NCCCCCCCCCCCCCCCC)[N+](=O)[O-]


InChI

InChI=1S/C36H69N5O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-35-34(41(42)43)36(40-33-39-35)38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33H,3-32H2,1-2H3,(H2,37,38,39,40)


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