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N4-cycloheptyl-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine

N4-cycloheptyl-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name:N4-cycloheptyl-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine
Openeye Name:N4-cycloheptyl-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine
CAS Name:N4-cycloheptyl-N6-hexadecyl-5-nitropyrimidine-4,6-diamine
IUPAC Name:4-N-cycloheptyl-6-N-hexadecyl-5-nitropyrimidine-4,6-diamine
Traditional Name:cetyl-[6-(cycloheptylamino)-5-nitro-pyrimidin-4-yl]amine
Formula: C27H49N5O2
MolecularWeight: 475.71026
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2


InChI

InChI=1S/C27H49N5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-22-28-26-25(32(33)34)27(30-23-29-26)31-24-20-17-14-15-18-21-24/h23-24H,2-22H2,1H3,(H2,28,29,30,31)


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