O5-(2-cyanoethyl) O3-(4-nitrophenyl) 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate

Systemtic Name: O5-(2-cyanoethyl) O3-(4-nitrophenyl) 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Openeye Name: O5-(2-cyanoethyl) O3-(4-nitrophenyl) 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate CAS Name: 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-(4-nitrophenyl) ester IUPAC Name: 5-O-(2-cyanoethyl) 3-O-(4-nitrophenyl) 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Traditional Name: 2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-(4-nitrophenyl) ester Formula: C23H19N5O9 MolecularWeight: 509.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=N1)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

Isomeric SMILES

CC1=C(C(N(C(=N1)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

InChI

InChI=1S/C23H19N5O9/c1-14-19(21(29)36-13-3-12-24)20(15-4-6-16(7-5-15)27(31)32)26(22(25-14)35-2)23(30)37-18-10-8-17(9-11-18)28(33)34/h4-11,20H,3,13H2,1-2H3