N,N-diethyl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: N,N-diethyl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: N,N-diethyl-6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N,N-diethyl-5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: N,N-diethyl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: diethyl-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C17H22N4O3 MolecularWeight: 330.38158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=NC=N1)OC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C(=NC=N1)OC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O3/c1-5-20(6-2)16-15(21(22)23)17(19-11-18-16)24-14-9-7-13(8-10-14)12(3)4/h7-12H,5-6H2,1-4H3