N-butyl-5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)pyrimidin-4-amine

Systemtic Name: N-butyl-5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)pyrimidin-4-amine Openeye Name: N-butyl-5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)pyrimidin-4-amine CAS Name: N-butyl-5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)-4-pyrimidinamine IUPAC Name: N-butyl-5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)pyrimidin-4-amine Traditional Name: butyl-[5-nitro-6-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)pyrimidin-4-yl]amine Formula: C18H29N5O2 MolecularWeight: 347.45516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CC3(CC2CC(C3)(C)C)C

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CC3(CC2CC(C3)(C)C)C

InChI

InChI=1S/C18H29N5O2/c1-5-6-7-19-15-14(23(24)25)16(21-12-20-15)22-11-18(4)9-13(22)8-17(2,3)10-18/h12-13H,5-11H2,1-4H3,(H,19,20,21)