ethyl 4-[[3-(4-ethoxyphenoxy)-5-nitro-phenyl]amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[[3-(4-ethoxyphenoxy)-5-nitro-phenyl]amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-[3-(4-ethoxyphenoxy)-5-nitro-anilino]quinazoline-2-carboxylate CAS Name: 4-[3-(4-ethoxyphenoxy)-5-nitroanilino]-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-ethoxyphenoxy)-5-nitroanilino]quinazoline-2-carboxylate Traditional Name: 4-[3-(4-ethoxyphenoxy)-5-nitro-anilino]quinazoline-2-carboxylic acid ethyl ester Formula: C25H22N4O6 MolecularWeight: 474.46538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC3=NC(=NC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC3=NC(=NC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C25H22N4O6/c1-3-33-18-9-11-19(12-10-18)35-20-14-16(13-17(15-20)29(31)32)26-23-21-7-5-6-8-22(21)27-24(28-23)25(30)34-4-2/h5-15H,3-4H2,1-2H3,(H,26,27,28)