N-hexadecyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-hexadecyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-hexadecyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-hexadecyl-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-hexadecyl-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: cetyl-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C24H43N5O2 MolecularWeight: 433.63052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C24H43N5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-23-22(29(30)31)24(27-21-26-23)28-19-16-17-20-28/h21H,2-20H2,1H3,(H,25,26,27)