methyl 4-[2-(2-morpholin-4-ylethylamino)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[2-(2-morpholin-4-ylethylamino)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: methyl 4-[2-(2-morpholinoethylamino)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[2-[2-(4-morpholinyl)ethylamino]ethyl]-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(2-morpholin-4-ylethylamino)ethyl]-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[2-(2-morpholinoethylamino)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylic acid methyl ester Formula: C26H29N5O5 MolecularWeight: 491.53896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(N=C1CCNCCN2CCOCC2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(N=C(N=C1CCNCCN2CCOCC2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H29N5O5/c1-35-26(32)23-22(10-11-27-12-13-30-14-16-36-17-15-30)28-25(19-6-3-2-4-7-19)29-24(23)20-8-5-9-21(18-20)31(33)34/h2-9,18,27H,10-17H2,1H3