6-(azepan-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(azepan-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(azepan-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-azepanyl)-N-butyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(azepan-1-yl)-N-butyl-5-nitropyrimidin-4-amine Traditional Name: [6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]-butyl-amine Formula: C14H23N5O2 MolecularWeight: 293.36472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

InChI

InChI=1S/C14H23N5O2/c1-2-3-8-15-13-12(19(20)21)14(17-11-16-13)18-9-6-4-5-7-10-18/h11H,2-10H2,1H3,(H,15,16,17)