ethyl 2-(2-morpholin-4-ylethanoylamino)-4-(3-nitrophenyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2-morpholin-4-ylethanoylamino)-4-(3-nitrophenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(2-morpholinoacetyl)amino]-4-(3-nitrophenyl)pyrimidine-5-carboxylate CAS Name: 2-[[2-(4-morpholinyl)-1-oxoethyl]amino]-4-(3-nitrophenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-morpholin-4-ylacetyl)amino]-4-(3-nitrophenyl)pyrimidine-5-carboxylate Traditional Name: 2-[(2-morpholinoacetyl)amino]-4-(3-nitrophenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H21N5O6 MolecularWeight: 415.39994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CN3CCOCC3

InChI

InChI=1S/C19H21N5O6/c1-2-30-18(26)15-11-20-19(21-16(25)12-23-6-8-29-9-7-23)22-17(15)13-4-3-5-14(10-13)24(27)28/h3-5,10-11H,2,6-9,12H2,1H3,(H,20,21,22,25)