N-cycloheptyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-cycloheptyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-cycloheptyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-cycloheptyl-6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-cycloheptyl-6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: cycloheptyl-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C19H24N4O3 MolecularWeight: 356.41886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3)C

InChI

InChI=1S/C19H24N4O3/c1-13-9-14(2)11-16(10-13)26-19-17(23(24)25)18(20-12-21-19)22-15-7-5-3-4-6-8-15/h9-12,15H,3-8H2,1-2H3,(H,20,21,22)