N-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine

Systemtic Name: N-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine Openeye Name: N-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine CAS Name: N-[6-(4-ethylphenoxy)-5-nitro-4-pyrimidinyl]-2-methyl-5-quinolinamine IUPAC Name: N-[6-(4-ethylphenoxy)-5-nitropyrimidin-4-yl]-2-methylquinolin-5-amine Traditional Name: [6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-(2-methyl-5-quinolyl)amine Formula: C22H19N5O3 MolecularWeight: 401.41796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC(=N4)C

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC(=N4)C

InChI

InChI=1S/C22H19N5O3/c1-3-15-8-10-16(11-9-15)30-22-20(27(28)29)21(23-13-24-22)26-19-6-4-5-18-17(19)12-7-14(2)25-18/h4-13H,3H2,1-2H3,(H,23,24,26)