propan-2-yl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylic acid isopropyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4/c1-13(2)28-21(25)18-14(3)22-20(15-8-5-4-6-9-15)23-19(18)16-10-7-11-17(12-16)24(26)27/h4-13H,1-3H3